2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide

C13H19N3O3S — CID 64818110

IUPAC2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide
SMILESNC1CCCC1C(=O)NCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C13H19N3O3S/c14-12-3-1-2-11(12)13(17)16-8-9-4-6-10(7-5-9)20(15,18)19/h4-7,11-12H,1-3,8,14H2,(H,16,17)(H2,15,18,19)
InChIKeyJGFDZFOSPLHJTL-UHFFFAOYSA-N
MW297.38 g/mol
LogP0.08
Rot. Bonds4

About 2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide

2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide (PubChem CID 64818110) has the molecular formula C13H19N3O3S and a molecular weight of 297.38 g/mol. Its IUPAC name is 2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide
PubChem CID64818110
Molecular FormulaC13H19N3O3S
Molecular Weight297.38 g/mol
Exact Mass297.11
IUPAC Name2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide
SMILESNC1CCCC1C(=O)NCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C13H19N3O3S/c14-12-3-1-2-11(12)13(17)16-8-9-4-6-10(7-5-9)20(15,18)19/h4-7,11-12H,1-3,8,14H2,(H,16,17)(H2,15,18,19)
InChIKeyJGFDZFOSPLHJTL-UHFFFAOYSA-N
XLogP0.08
TPSA115.28 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 50.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[(4-chlorophenyl)methyl]cyclopentane-1-carboxamide
CID 64823496
2-amino-N-(pyridin-4-ylmethyl)cyclopentane-1-carboxamide
CID 64824475
N-[(4-sulfamoylphenyl)methyl]cycloheptanecarboxamide
CID 10470657
N-[(4-acetamidophenyl)methyl]-2-aminocyclopentane-1-carboxamide
CID 64822288
2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide
CID 64822466
cis-(1S,2R)-2-phenyl-N-[(4-sulfamoylphenyl)methyl]cyclopropane-1-carboxamide
CID 40606359
(2S)-N-[(4-sulfamoylphenyl)methyl]pyrrolidine-2-carboxamide
CID 22691434
N-[(4-sulfamoylphenyl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119263305
2-amino-N-[[3-(hydroxymethyl)phenyl]methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119775473
4-amino-N-[(4-sulfamoylphenyl)methyl]cyclopent-2-ene-1-carboxamide
CID 79210828
(1R,2S,5R)-5-methyl-2-propan-2-yl-N-[(4-sulfamoylphenyl)methyl]cyclohexane-1-carboxamide
CID 59860935
2-amino-N-[(3-nitrophenyl)methyl]cyclopentane-1-carboxamide
CID 64824627

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide (CID 64818110) is 2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide is NC1CCCC1C(=O)NCc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide?
The InChIKey is JGFDZFOSPLHJTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3S/c14-12-3-1-2-11(12)13(17)16-8-9-4-6-10(7-5-9)20(15,18)19/h4-7,11-12H,1-3,8,14H2,(H,16,17)(H2,15,18,19).
What are the key properties of 2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide?
2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide has a molecular weight of 297.38 g/mol, XLogP of 0.08, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 64818110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).