N-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide

C19H20N2O4 — CID 110624279

IUPACN-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide
SMILESCOc1cccc(C(=O)CCC(=O)NCC(=O)Nc2ccccc2)c1
InChIInChI=1S/C19H20N2O4/c1-25-16-9-5-6-14(12-16)17(22)10-11-18(23)20-13-19(24)21-15-7-3-2-4-8-15/h2-9,12H,10-11,13H2,1H3,(H,20,23)(H,21,24)
InChIKeyHULROILGODWQOH-UHFFFAOYSA-N
MW340.38 g/mol
LogP2.41
Rot. Bonds8

About N-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide

N-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide (PubChem CID 110624279) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is N-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide.

Molecular Properties

Compound NameN-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide
PubChem CID110624279
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC NameN-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide
SMILESCOc1cccc(C(=O)CCC(=O)NCC(=O)Nc2ccccc2)c1
InChIInChI=1S/C19H20N2O4/c1-25-16-9-5-6-14(12-16)17(22)10-11-18(23)20-13-19(24)21-15-7-3-2-4-8-15/h2-9,12H,10-11,13H2,1H3,(H,20,23)(H,21,24)
InChIKeyHULROILGODWQOH-UHFFFAOYSA-N
XLogP2.41
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[4-(dimethylamino)anilino]-2-oxoethyl]-4-(3-methoxyphenyl)-4-oxobutanamide
CID 110606227
methyl 4-[[4-(3-methoxyphenyl)-4-oxobutanoyl]amino]benzoate
CID 110424348
N-[4-(dimethylamino)phenyl]-4-(3-methoxyphenyl)-4-oxobutanamide
CID 110424715
N-(4-bromo-3-methylphenyl)-4-(3-methoxyphenyl)-4-oxobutanamide
CID 110426251
N-[2-(3-methoxyanilino)-2-oxoethyl]pentanamide
CID 112998618
methyl 4-[[2-[(3-methoxybenzoyl)amino]acetyl]amino]benzoate
CID 26583191
N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide
CID 36915136
[2-(3-methoxyphenyl)-2-oxoethyl] 4-(4-methylanilino)-4-oxobutanoate
CID 3850666
N-[2-(3-methoxyanilino)-2-oxoethyl]-3-methylbenzamide
CID 4679398
4-oxo-N,4-diphenylbutanamide
CID 825307
2-(3-methoxyphenyl)-N-phenylacetamide
CID 2598681
N-[3-[[2-(3-methoxyanilino)acetyl]amino]phenyl]benzamide
CID 54814514

Frequently Asked Questions

What is the IUPAC name of N-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide?
The IUPAC name of N-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide (CID 110624279) is N-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide.
What is the SMILES notation for N-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide?
The canonical SMILES for N-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide is COc1cccc(C(=O)CCC(=O)NCC(=O)Nc2ccccc2)c1.
What is the InChIKey of N-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide?
The InChIKey is HULROILGODWQOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-25-16-9-5-6-14(12-16)17(22)10-11-18(23)20-13-19(24)21-15-7-3-2-4-8-15/h2-9,12H,10-11,13H2,1H3,(H,20,23)(H,21,24).
What are the key properties of N-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide?
N-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide has a molecular weight of 340.38 g/mol, XLogP of 2.41, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-anilino-2-oxoethyl)-4-(3-methoxyphenyl)-4-oxobutanamide is sourced from PubChem (CID 110624279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).