2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide

C15H15ClN2O2 — CID 623537

IUPAC2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide
SMILESCc1cc(C)c(C(N)=O)c(Oc2ccc(Cl)cc2C)n1
InChIInChI=1S/C15H15ClN2O2/c1-8-7-11(16)4-5-12(8)20-15-13(14(17)19)9(2)6-10(3)18-15/h4-7H,1-3H3,(H2,17,19)
InChIKeyZKRIUGDTEVEZAE-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.55
Rot. Bonds3

About 2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide

2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide (PubChem CID 623537) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide
PubChem CID623537
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide
SMILESCc1cc(C)c(C(N)=O)c(Oc2ccc(Cl)cc2C)n1
InChIInChI=1S/C15H15ClN2O2/c1-8-7-11(16)4-5-12(8)20-15-13(14(17)19)9(2)6-10(3)18-15/h4-7H,1-3H3,(H2,17,19)
InChIKeyZKRIUGDTEVEZAE-UHFFFAOYSA-N
XLogP3.55
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide?
The IUPAC name of 2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide (CID 623537) is 2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide?
The canonical SMILES for 2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide is Cc1cc(C)c(C(N)=O)c(Oc2ccc(Cl)cc2C)n1.
What is the InChIKey of 2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide?
The InChIKey is ZKRIUGDTEVEZAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-8-7-11(16)4-5-12(8)20-15-13(14(17)19)9(2)6-10(3)18-15/h4-7H,1-3H3,(H2,17,19).
What are the key properties of 2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide?
2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide has a molecular weight of 290.75 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 623537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).