2-(2-bromo-5-chloroanilino)propanamide

C9H10BrClN2O — CID 81281042

IUPAC2-(2-bromo-5-chloroanilino)propanamide
SMILESCC(Nc1cc(Cl)ccc1Br)C(N)=O
InChIInChI=1S/C9H10BrClN2O/c1-5(9(12)14)13-8-4-6(11)2-3-7(8)10/h2-5,13H,1H3,(H2,12,14)
InChIKeyOAWIDDXQBDIREO-UHFFFAOYSA-N
MW277.55 g/mol
LogP2.39
Rot. Bonds3

About 2-(2-bromo-5-chloroanilino)propanamide

2-(2-bromo-5-chloroanilino)propanamide (PubChem CID 81281042) has the molecular formula C9H10BrClN2O and a molecular weight of 277.55 g/mol. Its IUPAC name is 2-(2-bromo-5-chloroanilino)propanamide.

Molecular Properties

Compound Name2-(2-bromo-5-chloroanilino)propanamide
PubChem CID81281042
Molecular FormulaC9H10BrClN2O
Molecular Weight277.55 g/mol
Exact Mass275.97
IUPAC Name2-(2-bromo-5-chloroanilino)propanamide
SMILESCC(Nc1cc(Cl)ccc1Br)C(N)=O
InChIInChI=1S/C9H10BrClN2O/c1-5(9(12)14)13-8-4-6(11)2-3-7(8)10/h2-5,13H,1H3,(H2,12,14)
InChIKeyOAWIDDXQBDIREO-UHFFFAOYSA-N
XLogP2.39
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.55
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-5-chloroanilino)-N-cyclopropylpropanamide
CID 81280708
3-(2-bromo-5-chloroanilino)-2-methylpropanamide
CID 81280704
2-(2-bromo-5-chloroanilino)-N-phenylpropanamide
CID 81281522
2-(2-carbamothioyl-4-chloroanilino)propanamide
CID 62493509
2-amino-N-(2-bromo-5-chlorophenyl)propanamide
CID 81270376
N-(2-bromo-5-chlorophenyl)-2-methylbutanamide
CID 81271698
N-(2-bromo-5-chlorophenyl)-2-chloropropanamide
CID 81264583
2-(4-chloroanilino)propanamide
CID 43085931
N-(1-amino-1-oxopropan-2-yl)-2-bromo-4-chlorobenzamide
CID 103763560
(2S)-2-amino-N-(2-bromo-5-chlorophenyl)-3-methylbutanamide
CID 81271294
2-[(2-bromo-4-chlorophenyl)methylamino]propanamide
CID 81495277
(3Z)-3-amino-N-(2-bromo-5-chlorophenyl)-3-hydroxyimino-2-methylpropanamide
CID 81274652

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-5-chloroanilino)propanamide?
The IUPAC name of 2-(2-bromo-5-chloroanilino)propanamide (CID 81281042) is 2-(2-bromo-5-chloroanilino)propanamide.
What is the SMILES notation for 2-(2-bromo-5-chloroanilino)propanamide?
The canonical SMILES for 2-(2-bromo-5-chloroanilino)propanamide is CC(Nc1cc(Cl)ccc1Br)C(N)=O.
What is the InChIKey of 2-(2-bromo-5-chloroanilino)propanamide?
The InChIKey is OAWIDDXQBDIREO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrClN2O/c1-5(9(12)14)13-8-4-6(11)2-3-7(8)10/h2-5,13H,1H3,(H2,12,14).
What are the key properties of 2-(2-bromo-5-chloroanilino)propanamide?
2-(2-bromo-5-chloroanilino)propanamide has a molecular weight of 277.55 g/mol, XLogP of 2.39, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-5-chloroanilino)propanamide is sourced from PubChem (CID 81281042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).