3-(2,3-dichloroanilino)propanamide

C9H10Cl2N2O — CID 43152512

IUPAC3-(2,3-dichloroanilino)propanamide
SMILESNC(=O)CCNc1cccc(Cl)c1Cl
InChIInChI=1S/C9H10Cl2N2O/c10-6-2-1-3-7(9(6)11)13-5-4-8(12)14/h1-3,13H,4-5H2,(H2,12,14)
InChIKeyJKJSMMLGWKTMHE-UHFFFAOYSA-N
MW233.10 g/mol
LogP2.28
Rot. Bonds4

About 3-(2,3-dichloroanilino)propanamide

3-(2,3-dichloroanilino)propanamide (PubChem CID 43152512) has the molecular formula C9H10Cl2N2O and a molecular weight of 233.10 g/mol. Its IUPAC name is 3-(2,3-dichloroanilino)propanamide.

Molecular Properties

Compound Name3-(2,3-dichloroanilino)propanamide
PubChem CID43152512
Molecular FormulaC9H10Cl2N2O
Molecular Weight233.10 g/mol
Exact Mass232.02
IUPAC Name3-(2,3-dichloroanilino)propanamide
SMILESNC(=O)CCNc1cccc(Cl)c1Cl
InChIInChI=1S/C9H10Cl2N2O/c10-6-2-1-3-7(9(6)11)13-5-4-8(12)14/h1-3,13H,4-5H2,(H2,12,14)
InChIKeyJKJSMMLGWKTMHE-UHFFFAOYSA-N
XLogP2.28
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
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

5-(2,3-dichloroanilino)pentanoic acid
CID 28972138
5-(2-amino-3-chloroanilino)pentanamide
CID 106234126
3-(2,3-dichloroanilino)-N-(3-methylbutyl)propanamide
CID 109031980
3-(2-carbamoyl-3-chloroanilino)propanoic acid
CID 62501578
N-[2-(4-chlorophenyl)ethyl]-3-(2,3-dichloroanilino)propanamide
CID 109027992
3-(2,3-dichloroanilino)-N-(3-methoxypropyl)propanamide
CID 109015481
2-[(2,3-dichloroanilino)methyl]benzamide
CID 28774931
3-(4-bromo-2-chloroanilino)propanamide
CID 43347354
3-[2-chloro-6-(trifluoromethyl)anilino]propanamide
CID 43152515
2,3-dichloro-N-(3-fluoropropyl)aniline
CID 81106558
4-(2,3-dichloroanilino)-N'-hydroxy-2,2-dimethylbutanimidamide
CID 77062239
3-(2,3-dichloroanilino)butanamide
CID 82086378

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dichloroanilino)propanamide?
The IUPAC name of 3-(2,3-dichloroanilino)propanamide (CID 43152512) is 3-(2,3-dichloroanilino)propanamide.
What is the SMILES notation for 3-(2,3-dichloroanilino)propanamide?
The canonical SMILES for 3-(2,3-dichloroanilino)propanamide is NC(=O)CCNc1cccc(Cl)c1Cl.
What is the InChIKey of 3-(2,3-dichloroanilino)propanamide?
The InChIKey is JKJSMMLGWKTMHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10Cl2N2O/c10-6-2-1-3-7(9(6)11)13-5-4-8(12)14/h1-3,13H,4-5H2,(H2,12,14).
What are the key properties of 3-(2,3-dichloroanilino)propanamide?
3-(2,3-dichloroanilino)propanamide has a molecular weight of 233.10 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dichloroanilino)propanamide is sourced from PubChem (CID 43152512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).