6-(2-chlorophenoxy)-4-methylpyridin-3-amine

C12H11ClN2O — CID 79020774

IUPAC6-(2-chlorophenoxy)-4-methylpyridin-3-amine
SMILESCc1cc(Oc2ccccc2Cl)ncc1N
InChIInChI=1S/C12H11ClN2O/c1-8-6-12(15-7-10(8)14)16-11-5-3-2-4-9(11)13/h2-7H,14H2,1H3
InChIKeyUNFCZEFLKMSMAL-UHFFFAOYSA-N
MW234.69 g/mol
LogP3.42
Rot. Bonds2

About 6-(2-chlorophenoxy)-4-methylpyridin-3-amine

6-(2-chlorophenoxy)-4-methylpyridin-3-amine (PubChem CID 79020774) has the molecular formula C12H11ClN2O and a molecular weight of 234.69 g/mol. Its IUPAC name is 6-(2-chlorophenoxy)-4-methylpyridin-3-amine.

Molecular Properties

Compound Name6-(2-chlorophenoxy)-4-methylpyridin-3-amine
PubChem CID79020774
Molecular FormulaC12H11ClN2O
Molecular Weight234.69 g/mol
Exact Mass234.06
IUPAC Name6-(2-chlorophenoxy)-4-methylpyridin-3-amine
SMILESCc1cc(Oc2ccccc2Cl)ncc1N
InChIInChI=1S/C12H11ClN2O/c1-8-6-12(15-7-10(8)14)16-11-5-3-2-4-9(11)13/h2-7H,14H2,1H3
InChIKeyUNFCZEFLKMSMAL-UHFFFAOYSA-N
XLogP3.42
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.69
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(2-chlorophenoxy)-4-methylpyridin-3-amine 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 6-(2-chlorophenoxy)-4-methylpyridin-3-amine?
The IUPAC name of 6-(2-chlorophenoxy)-4-methylpyridin-3-amine (CID 79020774) is 6-(2-chlorophenoxy)-4-methylpyridin-3-amine.
What is the SMILES notation for 6-(2-chlorophenoxy)-4-methylpyridin-3-amine?
The canonical SMILES for 6-(2-chlorophenoxy)-4-methylpyridin-3-amine is Cc1cc(Oc2ccccc2Cl)ncc1N.
What is the InChIKey of 6-(2-chlorophenoxy)-4-methylpyridin-3-amine?
The InChIKey is UNFCZEFLKMSMAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O/c1-8-6-12(15-7-10(8)14)16-11-5-3-2-4-9(11)13/h2-7H,14H2,1H3.
What are the key properties of 6-(2-chlorophenoxy)-4-methylpyridin-3-amine?
6-(2-chlorophenoxy)-4-methylpyridin-3-amine has a molecular weight of 234.69 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-chlorophenoxy)-4-methylpyridin-3-amine is sourced from PubChem (CID 79020774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).