5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine

C8H11F2N3 — CID 130106302

IUPAC5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine
SMILESCc1c(CN)cnc(C(F)F)c1N
InChIInChI=1S/C8H11F2N3/c1-4-5(2-11)3-13-7(6(4)12)8(9)10/h3,8H,2,11-12H2,1H3
InChIKeyGXYKQNNJDQHWPA-UHFFFAOYSA-N
MW187.19 g/mol
LogP1.37
Rot. Bonds2

About 5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine

5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine (PubChem CID 130106302) has the molecular formula C8H11F2N3 and a molecular weight of 187.19 g/mol. Its IUPAC name is 5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine.

Molecular Properties

Compound Name5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine
PubChem CID130106302
Molecular FormulaC8H11F2N3
Molecular Weight187.19 g/mol
Exact Mass187.09
IUPAC Name5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine
SMILESCc1c(CN)cnc(C(F)F)c1N
InChIInChI=1S/C8H11F2N3/c1-4-5(2-11)3-13-7(6(4)12)8(9)10/h3,8H,2,11-12H2,1H3
InChIKeyGXYKQNNJDQHWPA-UHFFFAOYSA-N
XLogP1.37
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.19
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-amino-6-(difluoromethyl)-4-methyl-3-pyridinyl]acetic acid
CID 134663918
5-(aminomethyl)-6-(difluoromethyl)-4-methylpyridin-3-amine
CID 130106307
2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine
CID 130105197
[2-(difluoromethyl)-5-fluoro-3-methyl-4-pyridinyl]methanamine
CID 130080922
ethyl 5-(aminomethyl)-2-(difluoromethyl)-3-methylpyridine-4-carboxylate
CID 133084245
4-(bromomethyl)-2-(difluoromethyl)-5-methylpyridin-3-amine
CID 130106332
[4-(difluoromethyl)-2-(5-methylpyrimidin-2-yl)pyrimidin-5-yl]methanamine
CID 114206164
[5-(aminomethyl)-3-bromo-2-(difluoromethyl)-4-pyridinyl]methanol
CID 130070086
2-[5-amino-6-(difluoromethyl)-4-iodo-3-pyridinyl]acetonitrile
CID 130105418
3-bromo-5-(chloromethyl)-2-(difluoromethyl)-4-methylpyridine
CID 130069239
5-(bromomethyl)-2-(difluoromethyl)-4-iodo-3-methylpyridine
CID 130086035
5-(bromomethyl)-2-(difluoromethyl)-3,4-dimethylpyridine
CID 130101296

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine?
The IUPAC name of 5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine (CID 130106302) is 5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine.
What is the SMILES notation for 5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine?
The canonical SMILES for 5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine is Cc1c(CN)cnc(C(F)F)c1N.
What is the InChIKey of 5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine?
The InChIKey is GXYKQNNJDQHWPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F2N3/c1-4-5(2-11)3-13-7(6(4)12)8(9)10/h3,8H,2,11-12H2,1H3.
What are the key properties of 5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine?
5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine has a molecular weight of 187.19 g/mol, XLogP of 1.37, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-2-(difluoromethyl)-4-methylpyridin-3-amine is sourced from PubChem (CID 130106302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).