Home Amines 1202975-17-4
1202975-17-4,MFCD16653436
Catalog No.:AA01AQHJ
1202975-17-4 | ([1-(Cyclopropylsulfonyl)piperidin-4-yl]methyl)amine
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Technical Information
Catalog Number:
AA01AQHJ
Chemical Name:
([1-(Cyclopropylsulfonyl)piperidin-4-yl]methyl)amine
CAS Number:
1202975-17-4
Molecular Formula:
C9H18N2O2S
Molecular Weight:
218.3164
MDL Number:
MFCD16653436
IUPAC Name:
(1-cyclopropylsulfonylpiperidin-4-yl)methanamine
InChI:
InChI=1S/C9H18N2O2S/c10-7-8-3-5-11(6-4-8)14(12,13)9-1-2-9/h8-9H,1-7,10H2
InChI Key:
KATOPRGNWLPHKM-UHFFFAOYSA-N
SMILES:
NCC1CCN(CC1)S(=O)(=O)C1CC1
Properties
Computed Properties
 
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.109g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.315g/mol
Monoisotopic Mass:
218.109g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  

Synonyms
 
{[1-(cyclopropylsulfonyl)piperidin-4-yl]methyl}amine 
1202975-17-4 
ZINC38478419 
AKOS013878959 
MCULE-1496392539 
[1-(cyclopropanesulfonyl)piperidin-4-yl]methanamine 
A1-06191 
F2190-0723 
N/A 
Literature
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