2-(3-bromoanilino)-2-phenylpropanamide

C15H15BrN2O — CID 54891412

IUPAC2-(3-bromoanilino)-2-phenylpropanamide
SMILESCC(Nc1cccc(Br)c1)(C(N)=O)c1ccccc1
InChIInChI=1S/C15H15BrN2O/c1-15(14(17)19,11-6-3-2-4-7-11)18-13-9-5-8-12(16)10-13/h2-10,18H,1H3,(H2,17,19)
InChIKeyQAWZMHQJVDZXCZ-UHFFFAOYSA-N
MW319.20 g/mol
LogP3.26
Rot. Bonds4

About 2-(3-bromoanilino)-2-phenylpropanamide

2-(3-bromoanilino)-2-phenylpropanamide (PubChem CID 54891412) has the molecular formula C15H15BrN2O and a molecular weight of 319.20 g/mol. Its IUPAC name is 2-(3-bromoanilino)-2-phenylpropanamide.

Molecular Properties

Compound Name2-(3-bromoanilino)-2-phenylpropanamide
PubChem CID54891412
Molecular FormulaC15H15BrN2O
Molecular Weight319.20 g/mol
Exact Mass318.04
IUPAC Name2-(3-bromoanilino)-2-phenylpropanamide
SMILESCC(Nc1cccc(Br)c1)(C(N)=O)c1ccccc1
InChIInChI=1S/C15H15BrN2O/c1-15(14(17)19,11-6-3-2-4-7-11)18-13-9-5-8-12(16)10-13/h2-10,18H,1H3,(H2,17,19)
InChIKeyQAWZMHQJVDZXCZ-UHFFFAOYSA-N
XLogP3.26
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.20
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-bromoanilino)-2-(4-bromophenyl)propanamide
CID 60992244
2-(3-bromoanilino)-2-(4-methylphenyl)propanamide
CID 60991987
2-(3-bromoanilino)-2-(2-methylphenyl)propanamide
CID 60992122
2-(3-bromoanilino)-2-(3,4-dichlorophenyl)propanamide
CID 60992379
2-(3-bromoanilino)-2-(3-bromophenyl)propanoic acid
CID 60993850
2-(3-bromophenyl)-2-(4-chloroanilino)propanamide
CID 60992656
2-(3-methoxyanilino)-2-phenylpropanamide
CID 60990885
2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide
CID 60996711
2-(3-bromoanilino)-2-cyclopropylpropanamide
CID 61006538
2-anilino-2-[4-(dimethylamino)phenyl]propanamide
CID 61004832
2-(3-bromoanilino)-3,3-dimethoxy-2-methylpropanamide
CID 66165349
methyl 2-(3-bromoanilino)-2-(3-fluorophenyl)propanoate
CID 60993281

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromoanilino)-2-phenylpropanamide?
The IUPAC name of 2-(3-bromoanilino)-2-phenylpropanamide (CID 54891412) is 2-(3-bromoanilino)-2-phenylpropanamide.
What is the SMILES notation for 2-(3-bromoanilino)-2-phenylpropanamide?
The canonical SMILES for 2-(3-bromoanilino)-2-phenylpropanamide is CC(Nc1cccc(Br)c1)(C(N)=O)c1ccccc1.
What is the InChIKey of 2-(3-bromoanilino)-2-phenylpropanamide?
The InChIKey is QAWZMHQJVDZXCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O/c1-15(14(17)19,11-6-3-2-4-7-11)18-13-9-5-8-12(16)10-13/h2-10,18H,1H3,(H2,17,19).
What are the key properties of 2-(3-bromoanilino)-2-phenylpropanamide?
2-(3-bromoanilino)-2-phenylpropanamide has a molecular weight of 319.20 g/mol, XLogP of 3.26, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromoanilino)-2-phenylpropanamide is sourced from PubChem (CID 54891412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).