N-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide

C10H22N2O2S — CID 28940536

IUPACN-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide
SMILESCCCCS(=O)(=O)NC1(CN)CCCC1
InChIInChI=1S/C10H22N2O2S/c1-2-3-8-15(13,14)12-10(9-11)6-4-5-7-10/h12H,2-9,11H2,1H3
InChIKeyTYXPGYNQRXIJIK-UHFFFAOYSA-N
MW234.36 g/mol
LogP0.98
Rot. Bonds6

About N-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide

N-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide (PubChem CID 28940536) has the molecular formula C10H22N2O2S and a molecular weight of 234.36 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide
PubChem CID28940536
Molecular FormulaC10H22N2O2S
Molecular Weight234.36 g/mol
Exact Mass234.14
IUPAC NameN-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide
SMILESCCCCS(=O)(=O)NC1(CN)CCCC1
InChIInChI=1S/C10H22N2O2S/c1-2-3-8-15(13,14)12-10(9-11)6-4-5-7-10/h12H,2-9,11H2,1H3
InChIKeyTYXPGYNQRXIJIK-UHFFFAOYSA-N
XLogP0.98
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide
CID 28940534
N-[1-(aminomethyl)cyclopentyl]-2-propan-2-yloxyethanesulfonamide
CID 79594262
N-[1-(aminomethyl)cyclopentyl]-3-cyanopropane-1-sulfonamide
CID 86780680
N-[1-(aminomethyl)cyclopentyl]-4,4,4-trifluorobutane-1-sulfonamide
CID 83067789
N-[1-(aminomethyl)cyclopentyl]-3-fluoropropane-1-sulfonamide
CID 86780678
N-[3-(aminomethyl)pentan-3-yl]-3-fluoropropane-1-sulfonamide
CID 119981132
N-(1-amino-2,4-dimethylpentan-2-yl)-3-fluoropropane-1-sulfonamide
CID 119985002
N-(2-amino-2-ethylbutyl)-3-fluoropropane-1-sulfonamide
CID 119989710
N-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide
CID 120584859
N-[1-(aminomethyl)cyclopentyl]-4,4,4-trifluorobutane-1-sulfonamide;hydrochloride
CID 120875154
[1-(Aminomethyl)-3,3-dimethylcyclopentyl]methanesulfonamide
CID 21888236
[(1R)-1-(aminomethyl)-3,3-dimethylcyclopentyl]methanesulfonamide
CID 23563056

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide (CID 28940536) is N-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide is CCCCS(=O)(=O)NC1(CN)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide?
The InChIKey is TYXPGYNQRXIJIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2S/c1-2-3-8-15(13,14)12-10(9-11)6-4-5-7-10/h12H,2-9,11H2,1H3.
What are the key properties of N-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide?
N-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide has a molecular weight of 234.36 g/mol, XLogP of 0.98, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]butane-1-sulfonamide is sourced from PubChem (CID 28940536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).