N-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide

C18H20N2O2 — CID 46761793

IUPACN-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide
SMILESCC(=O)N(C)c1cccc(NC(=O)CCc2ccccc2)c1
InChIInChI=1S/C18H20N2O2/c1-14(21)20(2)17-10-6-9-16(13-17)19-18(22)12-11-15-7-4-3-5-8-15/h3-10,13H,11-12H2,1-2H3,(H,19,22)
InChIKeyOEZVFJNGJQZUPP-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.24
Rot. Bonds5

About N-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide

N-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide (PubChem CID 46761793) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is N-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide
PubChem CID46761793
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC NameN-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide
SMILESCC(=O)N(C)c1cccc(NC(=O)CCc2ccccc2)c1
InChIInChI=1S/C18H20N2O2/c1-14(21)20(2)17-10-6-9-16(13-17)19-18(22)12-11-15-7-4-3-5-8-15/h3-10,13H,11-12H2,1-2H3,(H,19,22)
InChIKeyOEZVFJNGJQZUPP-UHFFFAOYSA-N
XLogP3.24
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N'-bis[3-[acetyl(methyl)amino]phenyl]pentanediamide
CID 46762249
N-methyl-4-[[2-oxo-2-[3-(3-phenylpropanoylamino)anilino]ethyl]amino]-N-phenylbenzamide
CID 54838477
3-(4-aminophenyl)-N-[3-(dimethylamino)phenyl]propanamide
CID 115375741
3-[3-[acetyl(methyl)amino]phenyl]propanoic acid
CID 28760016
N-[2-(3-acetamido-N-acetylanilino)ethyl]-3-phenylpropanamide
CID 113061754
3-[3-(4-aminophenyl)propanoylamino]-N-methyl-N-phenylbenzamide
CID 54795361
N-[4-(dimethylamino)phenyl]-3-phenylpropanamide
CID 874810
2-[3-(3-phenylpropanoylamino)phenyl]acetic acid
CID 28759486
3-phenyl-N-(3-propan-2-ylphenyl)propanamide
CID 112765575
5-oxo-5-[3-(3-phenylpropanoylamino)anilino]pentanoic acid
CID 17222888
N-[3-[acetyl(methyl)amino]phenyl]-2-(2-methoxyphenoxy)acetamide
CID 46761828
N-[3-[methyl(methylsulfonyl)amino]phenyl]-3-(4-methylphenyl)propanamide
CID 41465695

Frequently Asked Questions

What is the IUPAC name of N-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide?
The IUPAC name of N-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide (CID 46761793) is N-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide.
What is the SMILES notation for N-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide?
The canonical SMILES for N-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide is CC(=O)N(C)c1cccc(NC(=O)CCc2ccccc2)c1.
What is the InChIKey of N-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide?
The InChIKey is OEZVFJNGJQZUPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-14(21)20(2)17-10-6-9-16(13-17)19-18(22)12-11-15-7-4-3-5-8-15/h3-10,13H,11-12H2,1-2H3,(H,19,22).
What are the key properties of N-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide?
N-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide has a molecular weight of 296.37 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[acetyl(methyl)amino]phenyl]-3-phenylpropanamide is sourced from PubChem (CID 46761793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).