2-(2,4-dichloroanilino)-N-methylpropanamide

C10H12Cl2N2O — CID 18321698

IUPAC2-(2,4-dichloroanilino)-N-methylpropanamide
SMILESCNC(=O)C(C)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C10H12Cl2N2O/c1-6(10(15)13-2)14-9-4-3-7(11)5-8(9)12/h3-6,14H,1-2H3,(H,13,15)
InChIKeyHODFMUGVUJRZCS-UHFFFAOYSA-N
MW247.12 g/mol
LogP2.54
Rot. Bonds3

About 2-(2,4-dichloroanilino)-N-methylpropanamide

2-(2,4-dichloroanilino)-N-methylpropanamide (PubChem CID 18321698) has the molecular formula C10H12Cl2N2O and a molecular weight of 247.12 g/mol. Its IUPAC name is 2-(2,4-dichloroanilino)-N-methylpropanamide.

Molecular Properties

Compound Name2-(2,4-dichloroanilino)-N-methylpropanamide
PubChem CID18321698
Molecular FormulaC10H12Cl2N2O
Molecular Weight247.12 g/mol
Exact Mass246.03
IUPAC Name2-(2,4-dichloroanilino)-N-methylpropanamide
SMILESCNC(=O)C(C)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C10H12Cl2N2O/c1-6(10(15)13-2)14-9-4-3-7(11)5-8(9)12/h3-6,14H,1-2H3,(H,13,15)
InChIKeyHODFMUGVUJRZCS-UHFFFAOYSA-N
XLogP2.54
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.12
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-4-methylanilino)-N-methylpropanamide
CID 43085457
N-cyclopropyl-2-(2,4-dichloroanilino)propanamide
CID 43085964
N-methyl-2-(2,4,5-trichloroanilino)propanamide
CID 43116604
2-(2-chloro-5-fluoroanilino)-N-methylpropanamide
CID 107528161
2-(2,5-dichloroanilino)-N-propan-2-ylpropanamide
CID 43084871
2-(5-chloro-2-fluoroanilino)-N-(methylcarbamoyl)propanamide
CID 43385595
2-(2,5-dichloroanilino)-N-phenylpropanamide
CID 43083844
2-(5-chloro-2,4-dimethoxyanilino)-N-methylpropanamide
CID 43085511
ethyl N-[4-[[1-(2,4-dichloroanilino)-1-oxopropan-2-yl]amino]phenyl]carbamate
CID 60542560
(2S)-2-(4-chloroanilino)-N-(2-chloro-4-fluorophenyl)propanamide
CID 7928544
N-cyclopropyl-2-(2,5-dichloroanilino)propanamide
CID 43083853
(2R)-2-(2-chloro-4-methylanilino)-N-(4-fluorophenyl)propanamide
CID 2475002

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichloroanilino)-N-methylpropanamide?
The IUPAC name of 2-(2,4-dichloroanilino)-N-methylpropanamide (CID 18321698) is 2-(2,4-dichloroanilino)-N-methylpropanamide.
What is the SMILES notation for 2-(2,4-dichloroanilino)-N-methylpropanamide?
The canonical SMILES for 2-(2,4-dichloroanilino)-N-methylpropanamide is CNC(=O)C(C)Nc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichloroanilino)-N-methylpropanamide?
The InChIKey is HODFMUGVUJRZCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2N2O/c1-6(10(15)13-2)14-9-4-3-7(11)5-8(9)12/h3-6,14H,1-2H3,(H,13,15).
What are the key properties of 2-(2,4-dichloroanilino)-N-methylpropanamide?
2-(2,4-dichloroanilino)-N-methylpropanamide has a molecular weight of 247.12 g/mol, XLogP of 2.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichloroanilino)-N-methylpropanamide is sourced from PubChem (CID 18321698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).