[3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine

C8H9ClF2N2O — CID 118836942

IUPAC[3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine
SMILESCOc1cc(C(F)F)c(Cl)c(CN)n1
InChIInChI=1S/C8H9ClF2N2O/c1-14-6-2-4(8(10)11)7(9)5(3-12)13-6/h2,8H,3,12H2,1H3
InChIKeyUBIKIFDKSFJFOY-UHFFFAOYSA-N
MW222.62 g/mol
LogP2.14
Rot. Bonds3

About [3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine

[3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine (PubChem CID 118836942) has the molecular formula C8H9ClF2N2O and a molecular weight of 222.62 g/mol. Its IUPAC name is [3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine
PubChem CID118836942
Molecular FormulaC8H9ClF2N2O
Molecular Weight222.62 g/mol
Exact Mass222.04
IUPAC Name[3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine
SMILESCOc1cc(C(F)F)c(Cl)c(CN)n1
InChIInChI=1S/C8H9ClF2N2O/c1-14-6-2-4(8(10)11)7(9)5(3-12)13-6/h2,8H,3,12H2,1H3
InChIKeyUBIKIFDKSFJFOY-UHFFFAOYSA-N
XLogP2.14
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.62
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine 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

2-(bromomethyl)-3-chloro-4-(difluoromethyl)-6-methoxypyridine
CID 130073739
2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine
CID 130105886
[3-(difluoromethyl)-4-fluoro-6-methoxy-2-pyridinyl]methanamine
CID 118848151
2-chloro-4-(difluoromethyl)-6-methoxypyridin-3-amine
CID 130102536
[6-(aminomethyl)-3-chloro-4-(difluoromethyl)-2-pyridinyl]methanol
CID 130074984
[4-(difluoromethyl)-3-methoxy-6-methyl-2-pyridinyl]methanamine
CID 118819899
2-chloro-3-(chloromethyl)-4-(difluoromethyl)-6-methoxypyridine
CID 119017981
[4-(difluoromethyl)-6-methoxy-2-(trifluoromethyl)-3-pyridinyl]methanamine
CID 133084898
methyl 2-[6-(aminomethyl)-3-chloro-4-(difluoromethyl)-2-pyridinyl]acetate
CID 134677861
[6-chloro-4-(difluoromethyl)-5-methoxy-2-pyridinyl]methanamine
CID 130073705
[4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine
CID 118820122
4-(difluoromethyl)-6-methoxy-2-methylpyridin-3-amine
CID 130105832

Frequently Asked Questions

What is the IUPAC name of [3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine?
The IUPAC name of [3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine (CID 118836942) is [3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine.
What is the SMILES notation for [3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine?
The canonical SMILES for [3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine is COc1cc(C(F)F)c(Cl)c(CN)n1.
What is the InChIKey of [3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine?
The InChIKey is UBIKIFDKSFJFOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClF2N2O/c1-14-6-2-4(8(10)11)7(9)5(3-12)13-6/h2,8H,3,12H2,1H3.
What are the key properties of [3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine?
[3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine has a molecular weight of 222.62 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-chloro-4-(difluoromethyl)-6-methoxy-2-pyridinyl]methanamine is sourced from PubChem (CID 118836942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).