N-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide

C14H21N3O3S — CID 63251945

IUPACN-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(C)c(S(=O)(=O)NC2CCCC2N)c1
InChIInChI=1S/C14H21N3O3S/c1-9-6-7-11(16-10(2)18)8-14(9)21(19,20)17-13-5-3-4-12(13)15/h6-8,12-13,17H,3-5,15H2,1-2H3,(H,16,18)
InChIKeyGXBYAAFYFXIIPW-UHFFFAOYSA-N
MW311.41 g/mol
LogP1.11
Rot. Bonds4

About N-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide

N-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide (PubChem CID 63251945) has the molecular formula C14H21N3O3S and a molecular weight of 311.41 g/mol. Its IUPAC name is N-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide
PubChem CID63251945
Molecular FormulaC14H21N3O3S
Molecular Weight311.41 g/mol
Exact Mass311.13
IUPAC NameN-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(C)c(S(=O)(=O)NC2CCCC2N)c1
InChIInChI=1S/C14H21N3O3S/c1-9-6-7-11(16-10(2)18)8-14(9)21(19,20)17-13-5-3-4-12(13)15/h6-8,12-13,17H,3-5,15H2,1-2H3,(H,16,18)
InChIKeyGXBYAAFYFXIIPW-UHFFFAOYSA-N
XLogP1.11
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
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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Related Compounds

3-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclohexane-1-carboxamide
CID 119797379
2-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]acetamide
CID 119331403
2-amino-N-(4-methyl-3-sulfamoylphenyl)cyclohexane-1-carboxamide
CID 64823639
N-[3-[(2-amino-2-cyclopropylethyl)sulfamoyl]-4-methylphenyl]acetamide
CID 115301298
N-[3-(3-aminopiperidin-1-yl)sulfonyl-4-methylphenyl]acetamide
CID 60777997
N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide
CID 39764000
2-[(5-fluoro-2-methylphenyl)sulfonylamino]cyclopentane-1-carboxamide
CID 71871357
N-[4-methyl-3-[2-(oxolan-2-yl)ethylsulfamoyl]phenyl]acetamide
CID 51076373
5-amino-N-[(1S,2S)-2-hydroxycyclohexyl]-2-methylbenzenesulfonamide
CID 107213448
4-methyl-3-[(2-methylcyclopentyl)sulfamoyl]benzoic acid
CID 63277680
1-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclopropane-1-carboxamide;hydrochloride
CID 119797364
N-(2-hydroxycyclohexyl)-2,5-dimethylbenzenesulfonamide
CID 55064031

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide?
The IUPAC name of N-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide (CID 63251945) is N-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide.
What is the SMILES notation for N-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide?
The canonical SMILES for N-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide is CC(=O)Nc1ccc(C)c(S(=O)(=O)NC2CCCC2N)c1.
What is the InChIKey of N-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide?
The InChIKey is GXBYAAFYFXIIPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3S/c1-9-6-7-11(16-10(2)18)8-14(9)21(19,20)17-13-5-3-4-12(13)15/h6-8,12-13,17H,3-5,15H2,1-2H3,(H,16,18).
What are the key properties of N-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide?
N-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide has a molecular weight of 311.41 g/mol, XLogP of 1.11, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-aminocyclopentyl)sulfamoyl]-4-methylphenyl]acetamide is sourced from PubChem (CID 63251945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).