N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide

C25H27NO — CID 17326867

IUPACN-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide
SMILESCCc1ccc(C(C)NC(=O)CC(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C25H27NO/c1-3-20-14-16-21(17-15-20)19(2)26-25(27)18-24(22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-17,19,24H,3,18H2,1-2H3,(H,26,27)
InChIKeyVZHZHLGQPMQDLV-UHFFFAOYSA-N
MW357.50 g/mol
LogP5.65
Rot. Bonds7

About N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide

N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide (PubChem CID 17326867) has the molecular formula C25H27NO and a molecular weight of 357.50 g/mol. Its IUPAC name is N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide.

Molecular Properties

Compound NameN-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide
PubChem CID17326867
Molecular FormulaC25H27NO
Molecular Weight357.50 g/mol
Exact Mass357.21
IUPAC NameN-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide
SMILESCCc1ccc(C(C)NC(=O)CC(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C25H27NO/c1-3-20-14-16-21(17-15-20)19(2)26-25(27)18-24(22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-17,19,24H,3,18H2,1-2H3,(H,26,27)
InChIKeyVZHZHLGQPMQDLV-UHFFFAOYSA-N
XLogP5.65
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.50
LogP ≤ 55.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(4-ethylphenyl)ethyl]-2-phenylacetamide
CID 2854113
3,3-diphenyl-N-[1-[4-(propanoylamino)phenyl]ethyl]propanamide
CID 46468381
3-[1-(4-ethylphenyl)ethylamino]-3-oxopropanoic acid
CID 55049684
N-[(1R)-1-(4-methoxyphenyl)ethyl]-3,3-diphenylpropanamide
CID 28572588
3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
CID 4793818
N-[1-(4-ethylphenyl)ethyl]-2-phenoxyacetamide
CID 17326821
N-[1-(4-ethylphenyl)ethyl]-3-oxobutanamide
CID 54896208
[2-[[(1R)-1-(4-ethylphenyl)ethyl]amino]-2-oxoethyl] benzoate
CID 7868318
3-phenyl-N-(1-phenylethyl)butanamide
CID 85158546
N-(1-phenylethyl)-3-trimethylsilylbutanamide
CID 101207602
5-[1-(4-ethylphenyl)ethylamino]-5-oxopentanoic acid
CID 60662045
N-[(1R)-1-(4-ethylphenyl)ethyl]-4-phenoxybutanamide
CID 100521099

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide?
The IUPAC name of N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide (CID 17326867) is N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide.
What is the SMILES notation for N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide?
The canonical SMILES for N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide is CCc1ccc(C(C)NC(=O)CC(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide?
The InChIKey is VZHZHLGQPMQDLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27NO/c1-3-20-14-16-21(17-15-20)19(2)26-25(27)18-24(22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-17,19,24H,3,18H2,1-2H3,(H,26,27).
What are the key properties of N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide?
N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide has a molecular weight of 357.50 g/mol, XLogP of 5.65, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide is sourced from PubChem (CID 17326867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).