N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide

C25H26N2O2 — CID 55726661

IUPACN-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide
SMILESCCc1ccc(CCC(=O)NC(C(=O)Nc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C25H26N2O2/c1-2-19-13-15-20(16-14-19)17-18-23(28)27-24(21-9-5-3-6-10-21)25(29)26-22-11-7-4-8-12-22/h3-16,24H,2,17-18H2,1H3,(H,26,29)(H,27,28)
InChIKeyFPJSATWASKFDAN-UHFFFAOYSA-N
MW386.50 g/mol
LogP4.68
Rot. Bonds8

About N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide

N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide (PubChem CID 55726661) has the molecular formula C25H26N2O2 and a molecular weight of 386.50 g/mol. Its IUPAC name is N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide.

Molecular Properties

Compound NameN-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide
PubChem CID55726661
Molecular FormulaC25H26N2O2
Molecular Weight386.50 g/mol
Exact Mass386.20
IUPAC NameN-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide
SMILESCCc1ccc(CCC(=O)NC(C(=O)Nc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C25H26N2O2/c1-2-19-13-15-20(16-14-19)17-18-23(28)27-24(21-9-5-3-6-10-21)25(29)26-22-11-7-4-8-12-22/h3-16,24H,2,17-18H2,1H3,(H,26,29)(H,27,28)
InChIKeyFPJSATWASKFDAN-UHFFFAOYSA-N
XLogP4.68
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide
CID 55779002
N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide
CID 55726687
2-(4-ethylphenoxy)-N-[4-(3-phenylpropanoylamino)phenyl]propanamide
CID 17233586
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-3-phenylpropanamide
CID 94514836
N-(4-ethylphenyl)-2-phenylbutanamide
CID 2905197
(2S)-2-[2-(4-fluorophenyl)ethylcarbamoylamino]-N,2-diphenylacetamide
CID 51957933
3-[4-(2-phenylbutanoylamino)phenyl]propanoic acid
CID 119252366
N-(2-anilino-2-oxo-1-phenylethyl)-4-(diethylaminomethyl)benzamide
CID 55779074
3-amino-N-(4-ethylphenyl)-2-methyl-3-phenylpropanamide
CID 80546370
3-(4-methylphenyl)-N-phenylpropanamide
CID 2995602
(2S)-2-[3-(4-ethylphenyl)propanoylamino]-3-hydroxypropanoic acid
CID 61152444
2-[4-[3-(4-ethylphenyl)propanoylamino]phenyl]acetic acid
CID 45346474

Frequently Asked Questions

What is the IUPAC name of N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide?
The IUPAC name of N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide (CID 55726661) is N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide.
What is the SMILES notation for N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide?
The canonical SMILES for N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide is CCc1ccc(CCC(=O)NC(C(=O)Nc2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide?
The InChIKey is FPJSATWASKFDAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O2/c1-2-19-13-15-20(16-14-19)17-18-23(28)27-24(21-9-5-3-6-10-21)25(29)26-22-11-7-4-8-12-22/h3-16,24H,2,17-18H2,1H3,(H,26,29)(H,27,28).
What are the key properties of N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide?
N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide has a molecular weight of 386.50 g/mol, XLogP of 4.68, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide is sourced from PubChem (CID 55726661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).