5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine

C12H10ClFN2O — CID 172626376

IUPAC5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine
SMILESCOc1cccc(F)c1-c1nc(N)ccc1Cl
InChIInChI=1S/C12H10ClFN2O/c1-17-9-4-2-3-8(14)11(9)12-7(13)5-6-10(15)16-12/h2-6H,1H3,(H2,15,16)
InChIKeyBHBURLJHTISIKU-UHFFFAOYSA-N
MW252.68 g/mol
LogP3.13
Rot. Bonds2

About 5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine

5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine (PubChem CID 172626376) has the molecular formula C12H10ClFN2O and a molecular weight of 252.68 g/mol. Its IUPAC name is 5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine
PubChem CID172626376
Molecular FormulaC12H10ClFN2O
Molecular Weight252.68 g/mol
Exact Mass252.05
IUPAC Name5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine
SMILESCOc1cccc(F)c1-c1nc(N)ccc1Cl
InChIInChI=1S/C12H10ClFN2O/c1-17-9-4-2-3-8(14)11(9)12-7(13)5-6-10(15)16-12/h2-6H,1H3,(H2,15,16)
InChIKeyBHBURLJHTISIKU-UHFFFAOYSA-N
XLogP3.13
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.68
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-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 5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine?
The IUPAC name of 5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine (CID 172626376) is 5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine?
The canonical SMILES for 5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine is COc1cccc(F)c1-c1nc(N)ccc1Cl.
What is the InChIKey of 5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine?
The InChIKey is BHBURLJHTISIKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClFN2O/c1-17-9-4-2-3-8(14)11(9)12-7(13)5-6-10(15)16-12/h2-6H,1H3,(H2,15,16).
What are the key properties of 5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine?
5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine has a molecular weight of 252.68 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(2-fluoro-6-methoxyphenyl)pyridin-2-amine is sourced from PubChem (CID 172626376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).