2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide

C14H17NO2 — CID 58413553

IUPAC2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide
SMILESCc1ccc(CC(=O)N[C@@H]2CCCC2=O)cc1
InChIInChI=1S/C14H17NO2/c1-10-5-7-11(8-6-10)9-14(17)15-12-3-2-4-13(12)16/h5-8,12H,2-4,9H2,1H3,(H,15,17)/t12-/m1/s1
InChIKeyYOWDYEHTEMTSHR-GFCCVEGCSA-N
MW231.30 g/mol
LogP1.78
Rot. Bonds3

About 2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide

2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide (PubChem CID 58413553) has the molecular formula C14H17NO2 and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide
PubChem CID58413553
Molecular FormulaC14H17NO2
Molecular Weight231.30 g/mol
Exact Mass231.13
IUPAC Name2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide
SMILESCc1ccc(CC(=O)N[C@@H]2CCCC2=O)cc1
InChIInChI=1S/C14H17NO2/c1-10-5-7-11(8-6-10)9-14(17)15-12-3-2-4-13(12)16/h5-8,12H,2-4,9H2,1H3,(H,15,17)/t12-/m1/s1
InChIKeyYOWDYEHTEMTSHR-GFCCVEGCSA-N
XLogP1.78
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-nitrophenyl)-N-[(1R)-2-oxocyclopentyl]acetamide
CID 58413628
2-(3,4-dichlorophenyl)-N-[(1S)-2-oxocyclopentyl]acetamide
CID 130333464
2-(2-bromophenyl)-N-[(1R)-2-oxocyclopentyl]acetamide
CID 58413596
2-(2-chlorophenyl)-N-[(1R)-2-oxocyclopentyl]acetamide
CID 58413586
4-methyl-N-[(2-oxocyclohexyl)carbamothioyl]benzamide
CID 11358251
(Z)-N-[(1S)-2-oxocyclopentyl]pent-3-enamide
CID 138638911
3-(4-methylphenyl)-N-(2-oxoazepan-3-yl)propanamide
CID 47031035
4-methyl-N-(2-oxocyclopentyl)benzamide;4-nitro-N-(2-oxocyclopentyl)benzamide
CID 123420478
3-(4-methylphenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 43915646
N-[(1R,2R)-2-aminocyclohexyl]-2-(4-methylphenyl)acetamide
CID 93451691
2-[(4-methylphenyl)methyl]cyclopentan-1-one
CID 18714737
2-(4-methylphenyl)-N-(oxan-4-yl)acetamide
CID 110726863

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide?
The IUPAC name of 2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide (CID 58413553) is 2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide.
What is the SMILES notation for 2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide?
The canonical SMILES for 2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide is Cc1ccc(CC(=O)N[C@@H]2CCCC2=O)cc1.
What is the InChIKey of 2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide?
The InChIKey is YOWDYEHTEMTSHR-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H17NO2/c1-10-5-7-11(8-6-10)9-14(17)15-12-3-2-4-13(12)16/h5-8,12H,2-4,9H2,1H3,(H,15,17)/t12-/m1/s1.
What are the key properties of 2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide?
2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide has a molecular weight of 231.30 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-N-[(1R)-2-oxocyclopentyl]acetamide is sourced from PubChem (CID 58413553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).