4-(3-phenylpropanoylamino)benzamide

C16H16N2O2 — CID 675903

IUPAC4-(3-phenylpropanoylamino)benzamide
SMILESNC(=O)c1ccc(NC(=O)CCc2ccccc2)cc1
InChIInChI=1S/C16H16N2O2/c17-16(20)13-7-9-14(10-8-13)18-15(19)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2,(H2,17,20)(H,18,19)
InChIKeyZZWKMAHRLQBKNY-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.36
Rot. Bonds5

About 4-(3-phenylpropanoylamino)benzamide

4-(3-phenylpropanoylamino)benzamide (PubChem CID 675903) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is 4-(3-phenylpropanoylamino)benzamide.

Molecular Properties

Compound Name4-(3-phenylpropanoylamino)benzamide
PubChem CID675903
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Name4-(3-phenylpropanoylamino)benzamide
SMILESNC(=O)c1ccc(NC(=O)CCc2ccccc2)cc1
InChIInChI=1S/C16H16N2O2/c17-16(20)13-7-9-14(10-8-13)18-15(19)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2,(H2,17,20)(H,18,19)
InChIKeyZZWKMAHRLQBKNY-UHFFFAOYSA-N
XLogP2.36
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-phenylpropanoylamino)benzoic acid
CID 10492186
3-phenyl-N-[4-(phenylcarbamoylamino)phenyl]propanamide
CID 17233492
N,N'-bis[4-(3-phenylpropanoylamino)phenyl]pentanediamide
CID 17233797
N-(4-aminosulfanylphenyl)-3-(4-fluorophenyl)propanamide;benzamide
CID 142474701
N-[4-(2-chloroethyl)phenyl]-3-phenylpropanamide
CID 114299237
acetic acid;N-[4-(hydrazinecarbonyl)phenyl]-3-phenylpropanamide
CID 172856727
N-(4-hydroxyphenyl)-3-phenylpropanamide
CID 836055
benzamide;N-[4-(tert-butylamino)sulfanylphenyl]-3-phenylpropanamide
CID 142474770
4-[3-(4-cyanophenyl)propanoylamino]benzamide
CID 41484593
N-[4-[(2-anilinoacetyl)amino]phenyl]-3-phenylpropanamide
CID 54810342
4-[(4-oxo-4-phenylbutanoyl)amino]benzamide
CID 9441934
N-(4-methylphenyl)-3-phenylpropanamide
CID 778861

Frequently Asked Questions

What is the IUPAC name of 4-(3-phenylpropanoylamino)benzamide?
The IUPAC name of 4-(3-phenylpropanoylamino)benzamide (CID 675903) is 4-(3-phenylpropanoylamino)benzamide.
What is the SMILES notation for 4-(3-phenylpropanoylamino)benzamide?
The canonical SMILES for 4-(3-phenylpropanoylamino)benzamide is NC(=O)c1ccc(NC(=O)CCc2ccccc2)cc1.
What is the InChIKey of 4-(3-phenylpropanoylamino)benzamide?
The InChIKey is ZZWKMAHRLQBKNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c17-16(20)13-7-9-14(10-8-13)18-15(19)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2,(H2,17,20)(H,18,19).
What are the key properties of 4-(3-phenylpropanoylamino)benzamide?
4-(3-phenylpropanoylamino)benzamide has a molecular weight of 268.32 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-phenylpropanoylamino)benzamide is sourced from PubChem (CID 675903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).