2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide

C13H19N3O4S — CID 64822574

IUPAC2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide
SMILESCOc1ccc(S(N)(=O)=O)cc1NC(=O)C1CCCC1N
InChIInChI=1S/C13H19N3O4S/c1-20-12-6-5-8(21(15,18)19)7-11(12)16-13(17)9-3-2-4-10(9)14/h5-7,9-10H,2-4,14H2,1H3,(H,16,17)(H2,15,18,19)
InChIKeySKXSDBBZXZVOSF-UHFFFAOYSA-N
MW313.38 g/mol
LogP0.41
Rot. Bonds4

About 2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide

2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide (PubChem CID 64822574) has the molecular formula C13H19N3O4S and a molecular weight of 313.38 g/mol. Its IUPAC name is 2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide
PubChem CID64822574
Molecular FormulaC13H19N3O4S
Molecular Weight313.38 g/mol
Exact Mass313.11
IUPAC Name2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide
SMILESCOc1ccc(S(N)(=O)=O)cc1NC(=O)C1CCCC1N
InChIInChI=1S/C13H19N3O4S/c1-20-12-6-5-8(21(15,18)19)7-11(12)16-13(17)9-3-2-4-10(9)14/h5-7,9-10H,2-4,14H2,1H3,(H,16,17)(H2,15,18,19)
InChIKeySKXSDBBZXZVOSF-UHFFFAOYSA-N
XLogP0.41
TPSA124.51 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.38
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxy-5-sulfamoylphenyl)-2-methylcyclopropane-1-carboxamide
CID 47154229
trans-(1R,2R)-2-[(2-methoxy-5-sulfamoylphenyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 129365678
N-(5-acetamido-2-methoxyphenyl)-2-aminocyclopentane-1-carboxamide
CID 64824915
2-amino-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide
CID 64818120
2-amino-N-(2-methoxy-5-nitrophenyl)cyclohexane-1-carboxamide
CID 64822909
(2R)-N-(2-methoxy-5-sulfamoylphenyl)piperidine-2-carboxamide
CID 104913098
2-amino-N-(2-methyl-5-methylsulfonylphenyl)cyclopentane-1-carboxamide
CID 64824704
N-(4-acetamido-3-methoxyphenyl)-2-aminocyclopentane-1-carboxamide
CID 64824304
3-[(2,6-dimethylcyclohexyl)amino]-4-methoxybenzenesulfonamide
CID 43743918
3-(cyclopropylamino)-4-methoxybenzenesulfonamide
CID 103439129
N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide
CID 107182876
N-(2-methoxy-5-sulfamoylphenyl)pyridazine-4-carboxamide
CID 115742519

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide (CID 64822574) is 2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide is COc1ccc(S(N)(=O)=O)cc1NC(=O)C1CCCC1N.
What is the InChIKey of 2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide?
The InChIKey is SKXSDBBZXZVOSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O4S/c1-20-12-6-5-8(21(15,18)19)7-11(12)16-13(17)9-3-2-4-10(9)14/h5-7,9-10H,2-4,14H2,1H3,(H,16,17)(H2,15,18,19).
What are the key properties of 2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide?
2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide has a molecular weight of 313.38 g/mol, XLogP of 0.41, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-methoxy-5-sulfamoylphenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 64822574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).