2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide

C16H24N2O3S — CID 113148924

IUPAC2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide
SMILESCc1cccc(NC(=O)CN(C2CCCC2)S(C)(=O)=O)c1C
InChIInChI=1S/C16H24N2O3S/c1-12-7-6-10-15(13(12)2)17-16(19)11-18(22(3,20)21)14-8-4-5-9-14/h6-7,10,14H,4-5,8-9,11H2,1-3H3,(H,17,19)
InChIKeyJPFRQFHIUYZZBD-UHFFFAOYSA-N
MW324.45 g/mol
LogP2.45
Rot. Bonds5

About 2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide

2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide (PubChem CID 113148924) has the molecular formula C16H24N2O3S and a molecular weight of 324.45 g/mol. Its IUPAC name is 2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide
PubChem CID113148924
Molecular FormulaC16H24N2O3S
Molecular Weight324.45 g/mol
Exact Mass324.15
IUPAC Name2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide
SMILESCc1cccc(NC(=O)CN(C2CCCC2)S(C)(=O)=O)c1C
InChIInChI=1S/C16H24N2O3S/c1-12-7-6-10-15(13(12)2)17-16(19)11-18(22(3,20)21)14-8-4-5-9-14/h6-7,10,14H,4-5,8-9,11H2,1-3H3,(H,17,19)
InChIKeyJPFRQFHIUYZZBD-UHFFFAOYSA-N
XLogP2.45
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cycloheptyl(methylsulfonyl)amino]-N-(2-methylphenyl)acetamide
CID 113153099
N-(3-chloro-2-methylphenyl)-2-[cyclohexyl(methylsulfonyl)amino]acetamide
CID 1287742
N-(2,3-dimethylphenyl)-2-[methyl-[(3R)-1-methylsulfonylpiperidin-3-yl]amino]acetamide
CID 97072442
2-[cycloheptyl(methylsulfonyl)amino]-N-(2-methoxyphenyl)acetamide
CID 113153135
2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2,3-dimethylphenyl)acetamide
CID 60911691
2-[cyclopentyl(methyl)amino]-N-[(2,3-dimethylphenyl)carbamoyl]acetamide
CID 51282081
ethyl 4-[[2-(2-methylanilino)-2-oxoethyl]-methylsulfonylamino]piperidine-1-carboxylate
CID 113152680
2-[cyclopentyl(methylsulfonyl)amino]-N-(3,4-dimethylphenyl)acetamide
CID 113148921
2-[cycloheptyl(methylsulfonyl)amino]-N-(4-methylphenyl)acetamide
CID 113153101
2-(2,6-dimethyl-N-methylsulfonylanilino)-N-(2,3-dimethylphenyl)acetamide
CID 113154012
N-(2,3-dimethylphenyl)-2-[(2-hydroxycyclohexyl)-methylamino]acetamide
CID 110883640
2-[cyclopentyl(methylsulfonyl)amino]-N-(2,4-difluorophenyl)acetamide
CID 113148994

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide?
The IUPAC name of 2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide (CID 113148924) is 2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide.
What is the SMILES notation for 2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide?
The canonical SMILES for 2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide is Cc1cccc(NC(=O)CN(C2CCCC2)S(C)(=O)=O)c1C.
What is the InChIKey of 2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide?
The InChIKey is JPFRQFHIUYZZBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3S/c1-12-7-6-10-15(13(12)2)17-16(19)11-18(22(3,20)21)14-8-4-5-9-14/h6-7,10,14H,4-5,8-9,11H2,1-3H3,(H,17,19).
What are the key properties of 2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide?
2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide has a molecular weight of 324.45 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(methylsulfonyl)amino]-N-(2,3-dimethylphenyl)acetamide is sourced from PubChem (CID 113148924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).