N-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide

C19H21NO2 — CID 157140681

IUPACN-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(CC(=O)CCc2ccccc2)cc1
InChIInChI=1S/C19H21NO2/c1-2-19(22)20-17-11-8-16(9-12-17)14-18(21)13-10-15-6-4-3-5-7-15/h3-9,11-12H,2,10,13-14H2,1H3,(H,20,22)
InChIKeyNAJUFPUQSCKCOB-UHFFFAOYSA-N
MW295.38 g/mol
LogP3.78
Rot. Bonds7

About N-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide

N-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide (PubChem CID 157140681) has the molecular formula C19H21NO2 and a molecular weight of 295.38 g/mol. Its IUPAC name is N-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide.

Molecular Properties

Compound NameN-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide
PubChem CID157140681
Molecular FormulaC19H21NO2
Molecular Weight295.38 g/mol
Exact Mass295.16
IUPAC NameN-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(CC(=O)CCc2ccccc2)cc1
InChIInChI=1S/C19H21NO2/c1-2-19(22)20-17-11-8-16(9-12-17)14-18(21)13-10-15-6-4-3-5-7-15/h3-9,11-12H,2,10,13-14H2,1H3,(H,20,22)
InChIKeyNAJUFPUQSCKCOB-UHFFFAOYSA-N
XLogP3.78
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[(2-phenylacetyl)amino]phenyl]propanamide
CID 1274275
2-phenyl-N-(4-propylphenyl)acetamide
CID 126501660
N-[4-[(3-phenylpropanoylamino)carbamoyl]phenyl]propanamide
CID 600576
N-(4-ethylphenyl)-2-phenylacetamide
CID 2684383
N-(4-methylphenyl)-3-phenylpropanamide
CID 778861
N-[4-(2-bromoethyl)phenyl]-2-phenylacetamide
CID 114310172
N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide
CID 55817357
N-[3-[[2-oxo-2-[4-(propanoylamino)anilino]ethyl]amino]phenyl]-3-phenylpropanamide
CID 54837505
2-[4-[3-(4-ethylphenyl)propanoylamino]phenyl]acetic acid
CID 45346474
N-(4-butylphenyl)-4-phenylbutanamide
CID 7313944
ethane;2-phenyl-N-[4-[[4-[(2-phenylacetyl)amino]phenyl]methyl]phenyl]acetamide
CID 123587423
N,N'-bis[4-(3-phenylpropanoylamino)phenyl]pentanediamide
CID 17233797

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide?
The IUPAC name of N-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide (CID 157140681) is N-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide.
What is the SMILES notation for N-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide?
The canonical SMILES for N-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide is CCC(=O)Nc1ccc(CC(=O)CCc2ccccc2)cc1.
What is the InChIKey of N-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide?
The InChIKey is NAJUFPUQSCKCOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2/c1-2-19(22)20-17-11-8-16(9-12-17)14-18(21)13-10-15-6-4-3-5-7-15/h3-9,11-12H,2,10,13-14H2,1H3,(H,20,22).
What are the key properties of N-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide?
N-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide has a molecular weight of 295.38 g/mol, XLogP of 3.78, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-oxo-4-phenylbutyl)phenyl]propanamide is sourced from PubChem (CID 157140681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).