N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide

C22H20N2O3 — CID 36915136

IUPACN-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide
SMILESCOc1cccc(NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C22H20N2O3/c1-27-20-9-5-8-19(14-20)24-21(25)15-23-22(26)18-12-10-17(11-13-18)16-6-3-2-4-7-16/h2-14H,15H2,1H3,(H,23,26)(H,24,25)
InChIKeyLXGKFLDZDAZWHQ-UHFFFAOYSA-N
MW360.41 g/mol
LogP3.73
Rot. Bonds6

About N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide

N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide (PubChem CID 36915136) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide.

Molecular Properties

Compound NameN-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide
PubChem CID36915136
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC NameN-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide
SMILESCOc1cccc(NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C22H20N2O3/c1-27-20-9-5-8-19(14-20)24-21(25)15-23-22(26)18-12-10-17(11-13-18)16-6-3-2-4-7-16/h2-14H,15H2,1H3,(H,23,26)(H,24,25)
InChIKeyLXGKFLDZDAZWHQ-UHFFFAOYSA-N
XLogP3.73
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[2-(3-methoxyphenoxy)anilino]-2-oxoethyl]-4-phenylbenzamide
CID 169183147
N-[2-(3-methoxyanilino)-2-oxoethyl]-3,4-dimethylbenzamide
CID 27167538
N-[2-(3-methoxyanilino)-2-oxoethyl]-3-methylbenzamide
CID 4679398
N-[2-(3-methoxyanilino)-2-oxoethyl]-2-methylbenzamide
CID 2234244
N-[3-[[2-(3-methoxyanilino)acetyl]amino]phenyl]benzamide
CID 54814514
3-methoxy-N-[2-[(4-phenylbenzoyl)amino]ethyl]benzamide
CID 40718395
1-N-benzyl-4-N-(3-methoxyphenyl)benzene-1,4-dicarboxamide
CID 109046735
methyl 4-[[2-[(3-methoxybenzoyl)amino]acetyl]amino]benzoate
CID 26583191
2-(hydroxyamino)-N-(3-methoxyphenyl)acetamide
CID 12611733
N-(2-anilino-2-oxoethyl)-4-methylbenzamide
CID 4010991
N-[2-(5-acetamido-2-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide
CID 37013397
N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 2968363

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide?
The IUPAC name of N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide (CID 36915136) is N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide.
What is the SMILES notation for N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide?
The canonical SMILES for N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide is COc1cccc(NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)c1.
What is the InChIKey of N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide?
The InChIKey is LXGKFLDZDAZWHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-27-20-9-5-8-19(14-20)24-21(25)15-23-22(26)18-12-10-17(11-13-18)16-6-3-2-4-7-16/h2-14H,15H2,1H3,(H,23,26)(H,24,25).
What are the key properties of N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide?
N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide has a molecular weight of 360.41 g/mol, XLogP of 3.73, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide is sourced from PubChem (CID 36915136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).