2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide

C27H23N3O2 — CID 9106026

IUPAC2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide
SMILESO=C(CNc1ccccc1C(=O)Nc1ccccc1)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C27H23N3O2/c31-26(30-25-18-10-7-15-22(25)20-11-3-1-4-12-20)19-28-24-17-9-8-16-23(24)27(32)29-21-13-5-2-6-14-21/h1-18,28H,19H2,(H,29,32)(H,30,31)
InChIKeyPFQUOFWKDVPVGN-UHFFFAOYSA-N
MW421.50 g/mol
LogP5.66
Rot. Bonds7

About 2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide

2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide (PubChem CID 9106026) has the molecular formula C27H23N3O2 and a molecular weight of 421.50 g/mol. Its IUPAC name is 2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide.

Molecular Properties

Compound Name2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide
PubChem CID9106026
Molecular FormulaC27H23N3O2
Molecular Weight421.50 g/mol
Exact Mass421.18
IUPAC Name2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide
SMILESO=C(CNc1ccccc1C(=O)Nc1ccccc1)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C27H23N3O2/c31-26(30-25-18-10-7-15-22(25)20-11-3-1-4-12-20)19-28-24-17-9-8-16-23(24)27(32)29-21-13-5-2-6-14-21/h1-18,28H,19H2,(H,29,32)(H,30,31)
InChIKeyPFQUOFWKDVPVGN-UHFFFAOYSA-N
XLogP5.66
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.50
LogP ≤ 55.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(2,4-dimethylanilino)-2-oxoethyl]amino]-N-phenylbenzamide
CID 9105938
2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide
CID 9106347
2-(2-acetylanilino)-N-phenylacetamide
CID 9103782
2-[(2-anilino-2-oxoethyl)amino]-N-(4-methoxyphenyl)benzamide
CID 9105493
2-(2-methoxyanilino)-N-(2-phenylphenyl)acetamide
CID 9080600
2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide
CID 9080400
2-phenyl-N-(2-phenylphenyl)benzamide
CID 2216278
2-[[2-(5-chloro-2-methylanilino)acetyl]amino]-N-phenylbenzamide
CID 16553153
2-[[2-(3-methoxyanilino)-2-oxoethyl]amino]-N-phenylbenzamide
CID 55355003
2-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide
CID 9106324
2-[[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]amino]-N-phenylbenzamide
CID 9105823
2-[[2-(5-chloro-2-cyanoanilino)-2-oxoethyl]amino]-N-phenylbenzamide
CID 9105872

Frequently Asked Questions

What is the IUPAC name of 2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide?
The IUPAC name of 2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide (CID 9106026) is 2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide.
What is the SMILES notation for 2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide?
The canonical SMILES for 2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide is O=C(CNc1ccccc1C(=O)Nc1ccccc1)Nc1ccccc1-c1ccccc1.
What is the InChIKey of 2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide?
The InChIKey is PFQUOFWKDVPVGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23N3O2/c31-26(30-25-18-10-7-15-22(25)20-11-3-1-4-12-20)19-28-24-17-9-8-16-23(24)27(32)29-21-13-5-2-6-14-21/h1-18,28H,19H2,(H,29,32)(H,30,31).
What are the key properties of 2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide?
2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide has a molecular weight of 421.50 g/mol, XLogP of 5.66, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide is sourced from PubChem (CID 9106026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).