2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine

C8H11F2N3O — CID 130105886

IUPAC2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine
SMILESCOc1cc(C(F)F)c(N)c(CN)n1
InChIInChI=1S/C8H11F2N3O/c1-14-6-2-4(8(9)10)7(12)5(3-11)13-6/h2,8H,3,11-12H2,1H3
InChIKeyOVOBOWYAHUEOIZ-UHFFFAOYSA-N
MW203.19 g/mol
LogP1.07
Rot. Bonds3

About 2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine

2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine (PubChem CID 130105886) has the molecular formula C8H11F2N3O and a molecular weight of 203.19 g/mol. Its IUPAC name is 2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine.

Molecular Properties

Compound Name2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine
PubChem CID130105886
Molecular FormulaC8H11F2N3O
Molecular Weight203.19 g/mol
Exact Mass203.09
IUPAC Name2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine
SMILESCOc1cc(C(F)F)c(N)c(CN)n1
InChIInChI=1S/C8H11F2N3O/c1-14-6-2-4(8(9)10)7(12)5(3-11)13-6/h2,8H,3,11-12H2,1H3
InChIKeyOVOBOWYAHUEOIZ-UHFFFAOYSA-N
XLogP1.07
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.19
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine?
The IUPAC name of 2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine (CID 130105886) is 2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine.
What is the SMILES notation for 2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine?
The canonical SMILES for 2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine is COc1cc(C(F)F)c(N)c(CN)n1.
What is the InChIKey of 2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine?
The InChIKey is OVOBOWYAHUEOIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F2N3O/c1-14-6-2-4(8(9)10)7(12)5(3-11)13-6/h2,8H,3,11-12H2,1H3.
What are the key properties of 2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine?
2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine has a molecular weight of 203.19 g/mol, XLogP of 1.07, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-4-(difluoromethyl)-6-methoxypyridin-3-amine is sourced from PubChem (CID 130105886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).