N-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide

C22H25NO2 — CID 78853741

IUPACN-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide
SMILESCc1ccc(C(=O)C(=O)N(CCc2ccccc2)C2CCCC2)cc1
InChIInChI=1S/C22H25NO2/c1-17-11-13-19(14-12-17)21(24)22(25)23(20-9-5-6-10-20)16-15-18-7-3-2-4-8-18/h2-4,7-8,11-14,20H,5-6,9-10,15-16H2,1H3
InChIKeyHYZADSBUSRUQKC-UHFFFAOYSA-N
MW335.45 g/mol
LogP4.19
Rot. Bonds6

About N-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide

N-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide (PubChem CID 78853741) has the molecular formula C22H25NO2 and a molecular weight of 335.45 g/mol. Its IUPAC name is N-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide
PubChem CID78853741
Molecular FormulaC22H25NO2
Molecular Weight335.45 g/mol
Exact Mass335.19
IUPAC NameN-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide
SMILESCc1ccc(C(=O)C(=O)N(CCc2ccccc2)C2CCCC2)cc1
InChIInChI=1S/C22H25NO2/c1-17-11-13-19(14-12-17)21(24)22(25)23(20-9-5-6-10-20)16-15-18-7-3-2-4-8-18/h2-4,7-8,11-14,20H,5-6,9-10,15-16H2,1H3
InChIKeyHYZADSBUSRUQKC-UHFFFAOYSA-N
XLogP4.19
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-cyclopentyl-N-(2-phenylethyl)butanamide
CID 78853681
N-cyclopentyl-2-(methylamino)-N-(2-phenylethyl)acetamide
CID 119771582
N-cyclohexyl-2,2,2-trifluoro-N-(2-phenylethyl)acetamide
CID 563302
N-cyclopentyl-N-(2-phenylethyl)pyridine-2-carboxamide
CID 86927162
N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide
CID 52574458
N-cyclopentyl-2-methyl-3-(methylamino)-N-(2-phenylethyl)propanamide
CID 119771590
N-cyclopentyl-N-(2-phenylethyl)-3-propan-2-yloxypropanamide
CID 78860123
N-cyclohexyl-N-ethyl-3-phenylpropanamide
CID 670110
N-(2-chloroethyl)-N-cyclopentyl-3-(4-methylphenyl)propanamide
CID 63391778
2-N-cyclohexyl-2-N-(2-phenylethyl)pyrazine-2,5-dicarboxamide
CID 137338224
N-cyclopentyl-2-[(1,1-dioxothiolan-3-yl)-methylamino]-N-(2-phenylethyl)acetamide
CID 78871349
4-[[cyclopentyl(2-phenylethyl)carbamoyl]amino]butanoic acid
CID 122022295

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide?
The IUPAC name of N-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide (CID 78853741) is N-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide.
What is the SMILES notation for N-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide?
The canonical SMILES for N-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide is Cc1ccc(C(=O)C(=O)N(CCc2ccccc2)C2CCCC2)cc1.
What is the InChIKey of N-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide?
The InChIKey is HYZADSBUSRUQKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25NO2/c1-17-11-13-19(14-12-17)21(24)22(25)23(20-9-5-6-10-20)16-15-18-7-3-2-4-8-18/h2-4,7-8,11-14,20H,5-6,9-10,15-16H2,1H3.
What are the key properties of N-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide?
N-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide has a molecular weight of 335.45 g/mol, XLogP of 4.19, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(4-methylphenyl)-2-oxo-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 78853741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).