3-phenyl-N-(4-propan-2-ylphenyl)propanamide

C18H21NO — CID 819687

IUPAC3-phenyl-N-(4-propan-2-ylphenyl)propanamide
SMILESCC(C)c1ccc(NC(=O)CCc2ccccc2)cc1
InChIInChI=1S/C18H21NO/c1-14(2)16-9-11-17(12-10-16)19-18(20)13-8-15-6-4-3-5-7-15/h3-7,9-12,14H,8,13H2,1-2H3,(H,19,20)
InChIKeyOJTXKJGEUZKCAB-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.38
Rot. Bonds5

About 3-phenyl-N-(4-propan-2-ylphenyl)propanamide

3-phenyl-N-(4-propan-2-ylphenyl)propanamide (PubChem CID 819687) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 3-phenyl-N-(4-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound Name3-phenyl-N-(4-propan-2-ylphenyl)propanamide
PubChem CID819687
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name3-phenyl-N-(4-propan-2-ylphenyl)propanamide
SMILESCC(C)c1ccc(NC(=O)CCc2ccccc2)cc1
InChIInChI=1S/C18H21NO/c1-14(2)16-9-11-17(12-10-16)19-18(20)13-8-15-6-4-3-5-7-15/h3-7,9-12,14H,8,13H2,1-2H3,(H,19,20)
InChIKeyOJTXKJGEUZKCAB-UHFFFAOYSA-N
XLogP4.38
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-hydroxyphenyl)-3-(4-propan-2-ylphenyl)propanamide
CID 56659537
3-(3-phenylpropylamino)-N-(4-propan-2-ylphenyl)propanamide
CID 109030939
3-[4-(benzylsulfamoyl)phenyl]-N-(4-propan-2-ylphenyl)propanamide
CID 126246447
3-phenyl-N-(3-propan-2-ylphenyl)propanamide
CID 112765575
N-(4-methylphenyl)-3-phenylpropanamide
CID 778861
N,N'-bis[4-(3-phenylpropanoylamino)phenyl]pentanediamide
CID 17233797
3-(4-ethoxyphenyl)-N-(4-propan-2-ylphenyl)propanamide
CID 19225956
N-(4-hydroxyphenyl)-3-phenylpropanamide
CID 836055
3-phenyl-N-[4-(phenylcarbamoylamino)phenyl]propanamide
CID 17233492
N-[4-[[2-(methylamino)acetyl]amino]phenyl]-3-phenylpropanamide
CID 54820849
4-(3-phenylpropanoylamino)benzoic acid
CID 10492186
3-phenylsulfanyl-N-(4-propan-2-ylphenyl)propanamide
CID 23973484

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-N-(4-propan-2-ylphenyl)propanamide?
The IUPAC name of 3-phenyl-N-(4-propan-2-ylphenyl)propanamide (CID 819687) is 3-phenyl-N-(4-propan-2-ylphenyl)propanamide.
What is the SMILES notation for 3-phenyl-N-(4-propan-2-ylphenyl)propanamide?
The canonical SMILES for 3-phenyl-N-(4-propan-2-ylphenyl)propanamide is CC(C)c1ccc(NC(=O)CCc2ccccc2)cc1.
What is the InChIKey of 3-phenyl-N-(4-propan-2-ylphenyl)propanamide?
The InChIKey is OJTXKJGEUZKCAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-14(2)16-9-11-17(12-10-16)19-18(20)13-8-15-6-4-3-5-7-15/h3-7,9-12,14H,8,13H2,1-2H3,(H,19,20).
What are the key properties of 3-phenyl-N-(4-propan-2-ylphenyl)propanamide?
3-phenyl-N-(4-propan-2-ylphenyl)propanamide has a molecular weight of 267.37 g/mol, XLogP of 4.38, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-N-(4-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 819687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).