3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide

C17H18Cl2N2O2 — CID 109038015

IUPAC3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide
SMILESCOc1cc(Cl)c(C)cc1NCCC(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C17H18Cl2N2O2/c1-11-8-15(16(23-2)10-14(11)19)20-7-6-17(22)21-13-5-3-4-12(18)9-13/h3-5,8-10,20H,6-7H2,1-2H3,(H,21,22)
InChIKeyGQGMACUYCWRSPQ-UHFFFAOYSA-N
MW353.25 g/mol
LogP4.75
Rot. Bonds6

About 3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide

3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide (PubChem CID 109038015) has the molecular formula C17H18Cl2N2O2 and a molecular weight of 353.25 g/mol. Its IUPAC name is 3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide.

Molecular Properties

Compound Name3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide
PubChem CID109038015
Molecular FormulaC17H18Cl2N2O2
Molecular Weight353.25 g/mol
Exact Mass352.07
IUPAC Name3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide
SMILESCOc1cc(Cl)c(C)cc1NCCC(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C17H18Cl2N2O2/c1-11-8-15(16(23-2)10-14(11)19)20-7-6-17(22)21-13-5-3-4-12(18)9-13/h3-5,8-10,20H,6-7H2,1-2H3,(H,21,22)
InChIKeyGQGMACUYCWRSPQ-UHFFFAOYSA-N
XLogP4.75
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.25
LogP ≤ 54.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chloro-4-methoxyphenyl)propanamide
CID 109039005
3-(4-chloro-2-methoxy-5-methylanilino)-N-(5-chloro-2-methylphenyl)propanamide
CID 109038425
3-(4-chloro-2-methoxy-5-methylanilino)-N-(4-propan-2-ylphenyl)propanamide
CID 109036891
N-(4-chloro-2-methoxy-5-methylphenyl)-3-(2,5-dichloroanilino)propanamide
CID 109042672
3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide
CID 109039788
3-(4-chloro-2-methoxy-5-methylanilino)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 109041770
N-(3-acetylphenyl)-3-(5-chloro-2-methoxyanilino)propanamide
CID 47824671
N-(3-chlorophenyl)-3-(2-ethoxyanilino)propanamide
CID 109037963
3-[[2-(4-chloro-2-methoxy-5-methylanilino)acetyl]amino]-N-ethylbenzamide
CID 51225156
methyl 4-chloro-3-[[3-(3-chloroanilino)-3-oxopropyl]amino]benzoate
CID 109037981
3-(4-bromoanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)propanamide
CID 109039271
3-(3-chloroanilino)-N-(2,4-dimethoxyphenyl)propanamide
CID 109038046

Frequently Asked Questions

What is the IUPAC name of 3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide?
The IUPAC name of 3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide (CID 109038015) is 3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide.
What is the SMILES notation for 3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide?
The canonical SMILES for 3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide is COc1cc(Cl)c(C)cc1NCCC(=O)Nc1cccc(Cl)c1.
What is the InChIKey of 3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide?
The InChIKey is GQGMACUYCWRSPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2O2/c1-11-8-15(16(23-2)10-14(11)19)20-7-6-17(22)21-13-5-3-4-12(18)9-13/h3-5,8-10,20H,6-7H2,1-2H3,(H,21,22).
What are the key properties of 3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide?
3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide has a molecular weight of 353.25 g/mol, XLogP of 4.75, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide is sourced from PubChem (CID 109038015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).