(2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide

C17H24N2O2 — CID 51562307

IUPAC(2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide
SMILESCC(=O)N[C@H](C(=O)Nc1ccc(C)cc1C)C1CCCC1
InChIInChI=1S/C17H24N2O2/c1-11-8-9-15(12(2)10-11)19-17(21)16(18-13(3)20)14-6-4-5-7-14/h8-10,14,16H,4-7H2,1-3H3,(H,18,20)(H,19,21)/t16-/m0/s1
InChIKeyUOEQUJDMNQNTPV-INIZCTEOSA-N
MW288.39 g/mol
LogP2.94
Rot. Bonds4

About (2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide

(2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide (PubChem CID 51562307) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is (2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide.

Molecular Properties

Compound Name(2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide
PubChem CID51562307
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name(2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide
SMILESCC(=O)N[C@H](C(=O)Nc1ccc(C)cc1C)C1CCCC1
InChIInChI=1S/C17H24N2O2/c1-11-8-9-15(12(2)10-11)19-17(21)16(18-13(3)20)14-6-4-5-7-14/h8-10,14,16H,4-7H2,1-3H3,(H,18,20)(H,19,21)/t16-/m0/s1
InChIKeyUOEQUJDMNQNTPV-INIZCTEOSA-N
XLogP2.94
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-acetamido-N-(4-chloro-2-methylphenyl)-2-cyclopentylacetamide
CID 51272169
2-acetamido-2-cyclopentyl-N-(2-methylphenyl)acetamide
CID 47126825
2-acetamido-N-(5-chloro-2-methylphenyl)-2-cyclopentylacetamide
CID 51272260
2-acetamido-N-(2-chlorophenyl)-2-cyclopentylacetamide
CID 42885299
(4-methylphenyl) 2-acetamido-2-cyclopentylacetate
CID 47126836
3-[(2-acetamido-2-cyclopentylacetyl)amino]-2-methylbenzamide
CID 86982911
2-acetamido-2-cyclopentyl-N-(2,3-dihydro-1H-inden-5-yl)acetamide
CID 17448058
1-(2,4-dimethylphenyl)-3-(2-methylcyclohexyl)urea
CID 17265372
N-(2,4-dimethylphenyl)cyclopropanecarboxamide
CID 5066654
(2S)-2-acetamido-N-cyclooctyl-2-cyclopentylacetamide
CID 94491136
[(2R)-1-(2,4-dimethylanilino)-1-oxopropan-2-yl] (1S,5R)-9-oxobicyclo[3.3.1]nonane-3-carboxylate
CID 27359764
(2S)-2-(3,5-dimethylphenoxy)-N-(2,4-dimethylphenyl)propanamide
CID 889131

Frequently Asked Questions

What is the IUPAC name of (2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide?
The IUPAC name of (2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide (CID 51562307) is (2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide.
What is the SMILES notation for (2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide?
The canonical SMILES for (2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide is CC(=O)N[C@H](C(=O)Nc1ccc(C)cc1C)C1CCCC1.
What is the InChIKey of (2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide?
The InChIKey is UOEQUJDMNQNTPV-INIZCTEOSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-11-8-9-15(12(2)10-11)19-17(21)16(18-13(3)20)14-6-4-5-7-14/h8-10,14,16H,4-7H2,1-3H3,(H,18,20)(H,19,21)/t16-/m0/s1.
What are the key properties of (2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide?
(2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide has a molecular weight of 288.39 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide is sourced from PubChem (CID 51562307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).