2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide

C15H22N2O3S — CID 64685014

IUPAC2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide
SMILESCc1ccc(S(C)(=O)=O)cc1NC(=O)CC1(N)CCCC1
InChIInChI=1S/C15H22N2O3S/c1-11-5-6-12(21(2,19)20)9-13(11)17-14(18)10-15(16)7-3-4-8-15/h5-6,9H,3-4,7-8,10,16H2,1-2H3,(H,17,18)
InChIKeyCMXKBFYOCQFDRP-UHFFFAOYSA-N
MW310.42 g/mol
LogP2.00
Rot. Bonds4

About 2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide

2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide (PubChem CID 64685014) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide
PubChem CID64685014
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC Name2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide
SMILESCc1ccc(S(C)(=O)=O)cc1NC(=O)CC1(N)CCCC1
InChIInChI=1S/C15H22N2O3S/c1-11-5-6-12(21(2,19)20)9-13(11)17-14(18)10-15(16)7-3-4-8-15/h5-6,9H,3-4,7-8,10,16H2,1-2H3,(H,17,18)
InChIKeyCMXKBFYOCQFDRP-UHFFFAOYSA-N
XLogP2.00
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-aminocyclobutyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide
CID 79851670
2-(1-aminocyclopentyl)-N-(2-methyl-5-sulfamoylphenyl)acetamide
CID 64685240
2-(1-aminocyclopentyl)-N-(5-fluoro-2-methylphenyl)acetamide
CID 64683745
2-(1-aminocyclopentyl)-N-(5-cyano-2-methylphenyl)acetamide
CID 64679673
2-(1-aminocyclobutyl)-N-(5-methoxy-2-methylphenyl)acetamide
CID 113266134
4-(methylamino)-N-(2-methyl-5-methylsulfonylphenyl)butanamide
CID 60843473
2-(1-aminocyclopentyl)-N-[(4-methylsulfonylphenyl)methyl]acetamide
CID 64679463
N-(2-methyl-5-methylsulfonylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 34194248
N-(2-methyl-5-methylsulfonylphenyl)-1-phenylcyclopropane-1-carboxamide
CID 51073188
2-[[2-(1-aminocyclopentyl)acetyl]amino]-6-methylbenzoic acid
CID 64676889
5-chloro-N-(2-methyl-5-methylsulfonylphenyl)pentanamide
CID 43346625
4-cyclohexyl-N-(2-methyl-5-methylsulfonylphenyl)butanamide
CID 33002263

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide?
The IUPAC name of 2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide (CID 64685014) is 2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide.
What is the SMILES notation for 2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide?
The canonical SMILES for 2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide is Cc1ccc(S(C)(=O)=O)cc1NC(=O)CC1(N)CCCC1.
What is the InChIKey of 2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide?
The InChIKey is CMXKBFYOCQFDRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c1-11-5-6-12(21(2,19)20)9-13(11)17-14(18)10-15(16)7-3-4-8-15/h5-6,9H,3-4,7-8,10,16H2,1-2H3,(H,17,18).
What are the key properties of 2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide?
2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide has a molecular weight of 310.42 g/mol, XLogP of 2.00, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide is sourced from PubChem (CID 64685014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).