2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide

C13H19N3O3S — CID 64823773

IUPAC2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide
SMILESCc1c(NC(=O)C2CCCC2N)cccc1S(N)(=O)=O
InChIInChI=1S/C13H19N3O3S/c1-8-11(6-3-7-12(8)20(15,18)19)16-13(17)9-4-2-5-10(9)14/h3,6-7,9-10H,2,4-5,14H2,1H3,(H,16,17)(H2,15,18,19)
InChIKeyZHCGTPVHBJZXLZ-UHFFFAOYSA-N
MW297.38 g/mol
LogP0.71
Rot. Bonds3

About 2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide

2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide (PubChem CID 64823773) has the molecular formula C13H19N3O3S and a molecular weight of 297.38 g/mol. Its IUPAC name is 2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide
PubChem CID64823773
Molecular FormulaC13H19N3O3S
Molecular Weight297.38 g/mol
Exact Mass297.11
IUPAC Name2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide
SMILESCc1c(NC(=O)C2CCCC2N)cccc1S(N)(=O)=O
InChIInChI=1S/C13H19N3O3S/c1-8-11(6-3-7-12(8)20(15,18)19)16-13(17)9-4-2-5-10(9)14/h3,6-7,9-10H,2,4-5,14H2,1H3,(H,16,17)(H2,15,18,19)
InChIKeyZHCGTPVHBJZXLZ-UHFFFAOYSA-N
XLogP0.71
TPSA115.28 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 50.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(2-methylphenyl)cyclopentane-1-carboxamide
CID 64818336
2-amino-N-(2-hydroxyphenyl)cyclopentane-1-carboxamide
CID 64852235
2-[(2-aminocyclopentanecarbonyl)amino]-6-methylbenzoic acid
CID 64851456
2-amino-N-(4-methyl-3-sulfamoylphenyl)cyclohexane-1-carboxamide
CID 64823639
N-(2-methyl-3-sulfamoylphenyl)piperidine-3-carboxamide
CID 60945170
2-amino-N-(2-methyl-5-methylsulfonylphenyl)cyclopentane-1-carboxamide
CID 64824704
5-methyl-N-(2-methyl-3-sulfamoylphenyl)oxolane-2-carboxamide
CID 80973976
2-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide
CID 64824088
2-amino-N-(3-bromo-2-hydroxyphenyl)cycloheptane-1-carboxamide
CID 81496913
2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide
CID 60944911
N-(2-methyl-3-sulfamoylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 78983267
2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide
CID 64822574

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide (CID 64823773) is 2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide is Cc1c(NC(=O)C2CCCC2N)cccc1S(N)(=O)=O.
What is the InChIKey of 2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide?
The InChIKey is ZHCGTPVHBJZXLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3S/c1-8-11(6-3-7-12(8)20(15,18)19)16-13(17)9-4-2-5-10(9)14/h3,6-7,9-10H,2,4-5,14H2,1H3,(H,16,17)(H2,15,18,19).
What are the key properties of 2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide?
2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide has a molecular weight of 297.38 g/mol, XLogP of 0.71, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-methyl-3-sulfamoylphenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 64823773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).