2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide

C14H21N3O3S — CID 60944911

IUPAC2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide
SMILESCc1c(NC(=O)CNC2CCCC2)cccc1S(N)(=O)=O
InChIInChI=1S/C14H21N3O3S/c1-10-12(7-4-8-13(10)21(15,19)20)17-14(18)9-16-11-5-2-3-6-11/h4,7-8,11,16H,2-3,5-6,9H2,1H3,(H,17,18)(H2,15,19,20)
InChIKeyHZGGVIFYXRDOIY-UHFFFAOYSA-N
MW311.41 g/mol
LogP1.11
Rot. Bonds5

About 2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide

2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide (PubChem CID 60944911) has the molecular formula C14H21N3O3S and a molecular weight of 311.41 g/mol. Its IUPAC name is 2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide
PubChem CID60944911
Molecular FormulaC14H21N3O3S
Molecular Weight311.41 g/mol
Exact Mass311.13
IUPAC Name2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide
SMILESCc1c(NC(=O)CNC2CCCC2)cccc1S(N)(=O)=O
InChIInChI=1S/C14H21N3O3S/c1-10-12(7-4-8-13(10)21(15,19)20)17-14(18)9-16-11-5-2-3-6-11/h4,7-8,11,16H,2-3,5-6,9H2,1H3,(H,17,18)(H2,15,19,20)
InChIKeyHZGGVIFYXRDOIY-UHFFFAOYSA-N
XLogP1.11
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.41
LogP ≤ 51.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide?
The IUPAC name of 2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide (CID 60944911) is 2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide is Cc1c(NC(=O)CNC2CCCC2)cccc1S(N)(=O)=O.
What is the InChIKey of 2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide?
The InChIKey is HZGGVIFYXRDOIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3S/c1-10-12(7-4-8-13(10)21(15,19)20)17-14(18)9-16-11-5-2-3-6-11/h4,7-8,11,16H,2-3,5-6,9H2,1H3,(H,17,18)(H2,15,19,20).
What are the key properties of 2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide?
2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide has a molecular weight of 311.41 g/mol, XLogP of 1.11, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylamino)-N-(2-methyl-3-sulfamoylphenyl)acetamide is sourced from PubChem (CID 60944911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).