2-(4-bromoanilino)-2-(2-bromophenyl)propanamide

C15H14Br2N2O — CID 60991854

IUPAC2-(4-bromoanilino)-2-(2-bromophenyl)propanamide
SMILESCC(Nc1ccc(Br)cc1)(C(N)=O)c1ccccc1Br
InChIInChI=1S/C15H14Br2N2O/c1-15(14(18)20,12-4-2-3-5-13(12)17)19-11-8-6-10(16)7-9-11/h2-9,19H,1H3,(H2,18,20)
InChIKeySIUCLNBOMOHIKN-UHFFFAOYSA-N
MW398.10 g/mol
LogP4.02
Rot. Bonds4

About 2-(4-bromoanilino)-2-(2-bromophenyl)propanamide

2-(4-bromoanilino)-2-(2-bromophenyl)propanamide (PubChem CID 60991854) has the molecular formula C15H14Br2N2O and a molecular weight of 398.10 g/mol. Its IUPAC name is 2-(4-bromoanilino)-2-(2-bromophenyl)propanamide.

Molecular Properties

Compound Name2-(4-bromoanilino)-2-(2-bromophenyl)propanamide
PubChem CID60991854
Molecular FormulaC15H14Br2N2O
Molecular Weight398.10 g/mol
Exact Mass395.95
IUPAC Name2-(4-bromoanilino)-2-(2-bromophenyl)propanamide
SMILESCC(Nc1ccc(Br)cc1)(C(N)=O)c1ccccc1Br
InChIInChI=1S/C15H14Br2N2O/c1-15(14(18)20,12-4-2-3-5-13(12)17)19-11-8-6-10(16)7-9-11/h2-9,19H,1H3,(H2,18,20)
InChIKeySIUCLNBOMOHIKN-UHFFFAOYSA-N
XLogP4.02
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.10
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromoanilino)-2-(2,4-dimethylphenyl)propanamide
CID 60991291
2-(4-bromoanilino)-2-pyridin-4-ylpropanamide
CID 54891362
2-(4-bromoanilino)-2-(4-chlorophenyl)propanamide
CID 60991718
2-(3-bromoanilino)-2-(2-methylphenyl)propanamide
CID 60992122
2-(4-bromo-2-fluorophenyl)-2-(4-fluoroanilino)propanamide
CID 82954183
2-(4-bromophenyl)-2-(4-methoxyanilino)propanamide
CID 60996145
2-(4-bromo-2-chlorophenyl)-2-(4-fluoroanilino)propanamide
CID 82776363
2-(3-bromoanilino)-2-(4-bromophenyl)propanamide
CID 60992244
2-anilino-2-(4-bromophenyl)propanoic acid
CID 60990809
2-(2-bromophenyl)-2-(3-methylanilino)propanoic acid
CID 60994633
2-(3-bromophenyl)-2-(4-chloroanilino)propanamide
CID 60992656
2-(3-bromoanilino)-2-phenylpropanamide
CID 54891412

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromoanilino)-2-(2-bromophenyl)propanamide?
The IUPAC name of 2-(4-bromoanilino)-2-(2-bromophenyl)propanamide (CID 60991854) is 2-(4-bromoanilino)-2-(2-bromophenyl)propanamide.
What is the SMILES notation for 2-(4-bromoanilino)-2-(2-bromophenyl)propanamide?
The canonical SMILES for 2-(4-bromoanilino)-2-(2-bromophenyl)propanamide is CC(Nc1ccc(Br)cc1)(C(N)=O)c1ccccc1Br.
What is the InChIKey of 2-(4-bromoanilino)-2-(2-bromophenyl)propanamide?
The InChIKey is SIUCLNBOMOHIKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Br2N2O/c1-15(14(18)20,12-4-2-3-5-13(12)17)19-11-8-6-10(16)7-9-11/h2-9,19H,1H3,(H2,18,20).
What are the key properties of 2-(4-bromoanilino)-2-(2-bromophenyl)propanamide?
2-(4-bromoanilino)-2-(2-bromophenyl)propanamide has a molecular weight of 398.10 g/mol, XLogP of 4.02, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromoanilino)-2-(2-bromophenyl)propanamide is sourced from PubChem (CID 60991854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).