2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide

C20H17BrN2O — CID 9080400

IUPAC2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide
SMILESO=C(CNc1cccc(Br)c1)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C20H17BrN2O/c21-16-9-6-10-17(13-16)22-14-20(24)23-19-12-5-4-11-18(19)15-7-2-1-3-8-15/h1-13,22H,14H2,(H,23,24)
InChIKeyCQRRLQZXLNODFG-UHFFFAOYSA-N
MW381.27 g/mol
LogP5.17
Rot. Bonds5

About 2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide

2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide (PubChem CID 9080400) has the molecular formula C20H17BrN2O and a molecular weight of 381.27 g/mol. Its IUPAC name is 2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide
PubChem CID9080400
Molecular FormulaC20H17BrN2O
Molecular Weight381.27 g/mol
Exact Mass380.05
IUPAC Name2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide
SMILESO=C(CNc1cccc(Br)c1)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C20H17BrN2O/c21-16-9-6-10-17(13-16)22-14-20(24)23-19-12-5-4-11-18(19)15-7-2-1-3-8-15/h1-13,22H,14H2,(H,23,24)
InChIKeyCQRRLQZXLNODFG-UHFFFAOYSA-N
XLogP5.17
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.27
LogP ≤ 55.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[2-(3-bromoanilino)acetyl]amino]benzamide
CID 54840155
3-(3-bromophenyl)-N-(2-phenylphenyl)propanamide
CID 112789618
2-(3-bromoanilino)-N-(4-bromo-2-fluorophenyl)acetamide
CID 9080342
N-[3-[[2-(3-bromoanilino)acetyl]amino]phenyl]benzamide
CID 54840105
2-[[2-oxo-2-(2-phenylanilino)ethyl]amino]-N-phenylbenzamide
CID 9106026
2-(3-bromoanilino)-N-(2-chloro-4-methylphenyl)acetamide
CID 9080359
2-(4-bromoanilino)-N-(3-bromophenyl)acetamide
CID 7492464
2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide
CID 9080372
2-(3-bromoanilino)-N-(4-iodophenyl)acetamide
CID 26416177
3-[[2-(2-bromoanilino)-2-oxoethyl]amino]benzamide
CID 54842256
2-(2-methoxyanilino)-N-(2-phenylphenyl)acetamide
CID 9080600
4-[[2-(3-bromoanilino)acetyl]amino]benzamide
CID 46633398

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide?
The IUPAC name of 2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide (CID 9080400) is 2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide.
What is the SMILES notation for 2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide?
The canonical SMILES for 2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide is O=C(CNc1cccc(Br)c1)Nc1ccccc1-c1ccccc1.
What is the InChIKey of 2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide?
The InChIKey is CQRRLQZXLNODFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17BrN2O/c21-16-9-6-10-17(13-16)22-14-20(24)23-19-12-5-4-11-18(19)15-7-2-1-3-8-15/h1-13,22H,14H2,(H,23,24).
What are the key properties of 2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide?
2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide has a molecular weight of 381.27 g/mol, XLogP of 5.17, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromoanilino)-N-(2-phenylphenyl)acetamide is sourced from PubChem (CID 9080400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).