2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide

C20H25NO — CID 86249193

IUPAC2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide
SMILESCC(C)Cc1ccc(CC(=O)NC(C)c2ccccc2)cc1
InChIInChI=1S/C20H25NO/c1-15(2)13-17-9-11-18(12-10-17)14-20(22)21-16(3)19-7-5-4-6-8-19/h4-12,15-16H,13-14H2,1-3H3,(H,21,22)
InChIKeyGVTAVZHFRPMZFB-UHFFFAOYSA-N
MW295.43 g/mol
LogP4.30
Rot. Bonds6

About 2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide

2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide (PubChem CID 86249193) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is 2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide.

Molecular Properties

Compound Name2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide
PubChem CID86249193
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC Name2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide
SMILESCC(C)Cc1ccc(CC(=O)NC(C)c2ccccc2)cc1
InChIInChI=1S/C20H25NO/c1-15(2)13-17-9-11-18(12-10-17)14-20(22)21-16(3)19-7-5-4-6-8-19/h4-12,15-16H,13-14H2,1-3H3,(H,21,22)
InChIKeyGVTAVZHFRPMZFB-UHFFFAOYSA-N
XLogP4.30
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[4-(aminomethyl)phenyl]-N-[(1R)-1-phenylethyl]acetamide
CID 107863936
N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide
CID 42902003
2-(2-fluorophenyl)-N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 7936631
(2S)-2-[4-(2-methylpropyl)phenyl]-N-[(1S)-1-phenylethyl]propanamide
CID 1207292
N-[1-(4-ethylphenyl)ethyl]-2-phenylacetamide
CID 2854113
N-[1-[4-(2-methylpropyl)phenyl]ethyl]benzamide
CID 4837318
N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]benzamide
CID 2452902
N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]benzamide
CID 2452904
2-[4-(2-methylpropyl)phenyl]-N-propan-2-ylacetamide
CID 78814712
2-(4-carbamothioylphenyl)-N-(1-phenylethyl)acetamide
CID 63589427
2-(4-nitrophenyl)-N-(1-phenylethyl)acetamide
CID 2726136
N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-nitrophenyl)acetamide
CID 42997256

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide?
The IUPAC name of 2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide (CID 86249193) is 2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide.
What is the SMILES notation for 2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide?
The canonical SMILES for 2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide is CC(C)Cc1ccc(CC(=O)NC(C)c2ccccc2)cc1.
What is the InChIKey of 2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide?
The InChIKey is GVTAVZHFRPMZFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO/c1-15(2)13-17-9-11-18(12-10-17)14-20(22)21-16(3)19-7-5-4-6-8-19/h4-12,15-16H,13-14H2,1-3H3,(H,21,22).
What are the key properties of 2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide?
2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide has a molecular weight of 295.43 g/mol, XLogP of 4.30, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide is sourced from PubChem (CID 86249193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).