[3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine

C8H9ClF2N2 — CID 118829811

IUPAC[3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine
SMILESCc1cnc(C(F)F)c(Cl)c1CN
InChIInChI=1S/C8H9ClF2N2/c1-4-3-13-7(8(10)11)6(9)5(4)2-12/h3,8H,2,12H2,1H3
InChIKeyJTFBBQPFOWQFPQ-UHFFFAOYSA-N
MW206.62 g/mol
LogP2.44
Rot. Bonds2

About [3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine

[3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine (PubChem CID 118829811) has the molecular formula C8H9ClF2N2 and a molecular weight of 206.62 g/mol. Its IUPAC name is [3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine
PubChem CID118829811
Molecular FormulaC8H9ClF2N2
Molecular Weight206.62 g/mol
Exact Mass206.04
IUPAC Name[3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine
SMILESCc1cnc(C(F)F)c(Cl)c1CN
InChIInChI=1S/C8H9ClF2N2/c1-4-3-13-7(8(10)11)6(9)5(4)2-12/h3,8H,2,12H2,1H3
InChIKeyJTFBBQPFOWQFPQ-UHFFFAOYSA-N
XLogP2.44
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.62
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [3-chloro-2-(difluoromethyl)-5-methyl-4-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

4-(aminomethyl)-2-(difluoromethyl)-5-methylpyridine-3-carbaldehyde
CID 130088514
ethyl 2-[5-(aminomethyl)-4-chloro-6-(difluoromethyl)-3-pyridinyl]acetate
CID 134684866
5-(aminomethyl)-6-(difluoromethyl)-4-methylpyridin-3-amine
CID 130106307
[2-(difluoromethyl)-5-fluoro-3-methyl-4-pyridinyl]methanamine
CID 130080922
4-(bromomethyl)-2-(difluoromethyl)-3-iodo-5-methylpyridine
CID 130086022
4-(bromomethyl)-2-(difluoromethyl)-5-methylpyridin-3-amine
CID 130106332
3-(chloromethyl)-2-(difluoromethyl)-5-methylpyridin-4-amine
CID 130106398
3,5-dichloro-2-(difluoromethyl)-4-methylpyridine
CID 130099262
[2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine
CID 130097549
ethyl 5-chloro-4-(chloromethyl)-6-(difluoromethyl)pyridine-3-carboxylate
CID 134674227
3-(aminomethyl)-5-chloro-2-(difluoromethyl)pyridine-4-carbonitrile
CID 130071103
2-[5-bromo-3-chloro-2-(difluoromethyl)-4-pyridinyl]acetic acid
CID 130108376

Frequently Asked Questions

What is the IUPAC name of [3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine?
The IUPAC name of [3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine (CID 118829811) is [3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine.
What is the SMILES notation for [3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine?
The canonical SMILES for [3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine is Cc1cnc(C(F)F)c(Cl)c1CN.
What is the InChIKey of [3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine?
The InChIKey is JTFBBQPFOWQFPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClF2N2/c1-4-3-13-7(8(10)11)6(9)5(4)2-12/h3,8H,2,12H2,1H3.
What are the key properties of [3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine?
[3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine has a molecular weight of 206.62 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine is sourced from PubChem (CID 118829811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).