2-(3,5-dichloroanilino)propanamide

C9H10Cl2N2O — CID 43085996

IUPAC2-(3,5-dichloroanilino)propanamide
SMILESCC(Nc1cc(Cl)cc(Cl)c1)C(N)=O
InChIInChI=1S/C9H10Cl2N2O/c1-5(9(12)14)13-8-3-6(10)2-7(11)4-8/h2-5,13H,1H3,(H2,12,14)
InChIKeyKMTXTCWARDTBHL-UHFFFAOYSA-N
MW233.10 g/mol
LogP2.28
Rot. Bonds3

About 2-(3,5-dichloroanilino)propanamide

2-(3,5-dichloroanilino)propanamide (PubChem CID 43085996) has the molecular formula C9H10Cl2N2O and a molecular weight of 233.10 g/mol. Its IUPAC name is 2-(3,5-dichloroanilino)propanamide.

Molecular Properties

Compound Name2-(3,5-dichloroanilino)propanamide
PubChem CID43085996
Molecular FormulaC9H10Cl2N2O
Molecular Weight233.10 g/mol
Exact Mass232.02
IUPAC Name2-(3,5-dichloroanilino)propanamide
SMILESCC(Nc1cc(Cl)cc(Cl)c1)C(N)=O
InChIInChI=1S/C9H10Cl2N2O/c1-5(9(12)14)13-8-3-6(10)2-7(11)4-8/h2-5,13H,1H3,(H2,12,14)
InChIKeyKMTXTCWARDTBHL-UHFFFAOYSA-N
XLogP2.28
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.10
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl (2S)-2-(3,5-dichloroanilino)propanoate
CID 26599088
(2R)-2-(3-chloroanilino)propanamide;hydrochloride
CID 164755970
2-(4-chloroanilino)propanamide
CID 43085931
2-(3,4,5-trifluoroanilino)propanamide
CID 62808882
2-(4-fluoro-3,5-dimethylanilino)propanamide
CID 143730573
3,5-dichloro-N-propan-2-ylaniline
CID 2758170
2-(3-chloro-5-fluoroanilino)propanoic acid
CID 107363833
(2S)-2-(3,5-dichloroanilino)-N-hexan-2-ylpropanamide;methanamine
CID 172781783
2-(2-bromo-5-chloroanilino)propanamide
CID 81281042
2-(3-chloro-5-fluoroanilino)-N-propan-2-ylpropanamide
CID 107365072
N-(3,5-dichlorophenyl)-2-methylpropanamide
CID 797394
methyl (2S)-2-(4-chloroanilino)propanoate
CID 18442844

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichloroanilino)propanamide?
The IUPAC name of 2-(3,5-dichloroanilino)propanamide (CID 43085996) is 2-(3,5-dichloroanilino)propanamide.
What is the SMILES notation for 2-(3,5-dichloroanilino)propanamide?
The canonical SMILES for 2-(3,5-dichloroanilino)propanamide is CC(Nc1cc(Cl)cc(Cl)c1)C(N)=O.
What is the InChIKey of 2-(3,5-dichloroanilino)propanamide?
The InChIKey is KMTXTCWARDTBHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10Cl2N2O/c1-5(9(12)14)13-8-3-6(10)2-7(11)4-8/h2-5,13H,1H3,(H2,12,14).
What are the key properties of 2-(3,5-dichloroanilino)propanamide?
2-(3,5-dichloroanilino)propanamide has a molecular weight of 233.10 g/mol, XLogP of 2.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichloroanilino)propanamide is sourced from PubChem (CID 43085996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).