4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine

C7H8F3N3 — CID 130103996

IUPAC4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine
SMILESNCc1c(N)cnc(C(F)F)c1F
InChIInChI=1S/C7H8F3N3/c8-5-3(1-11)4(12)2-13-6(5)7(9)10/h2,7H,1,11-12H2
InChIKeyGPAZZRVRHHXQHZ-UHFFFAOYSA-N
MW191.16 g/mol
LogP1.20
Rot. Bonds2

About 4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine

4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine (PubChem CID 130103996) has the molecular formula C7H8F3N3 and a molecular weight of 191.16 g/mol. Its IUPAC name is 4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine.

Molecular Properties

Compound Name4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine
PubChem CID130103996
Molecular FormulaC7H8F3N3
Molecular Weight191.16 g/mol
Exact Mass191.07
IUPAC Name4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine
SMILESNCc1c(N)cnc(C(F)F)c1F
InChIInChI=1S/C7H8F3N3/c8-5-3(1-11)4(12)2-13-6(5)7(9)10/h2,7H,1,11-12H2
InChIKeyGPAZZRVRHHXQHZ-UHFFFAOYSA-N
XLogP1.20
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.16
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(difluoromethyl)-3-fluoro-5-iodo-4-pyridinyl]methanamine
CID 118801498
5-(aminomethyl)-6-(difluoromethyl)-4-methylpyridin-3-amine
CID 130106307
2-[4-(aminomethyl)-6-(difluoromethyl)-5-fluoro-3-pyridinyl]acetonitrile
CID 118812879
5-(aminomethyl)-4-(difluoromethyl)-6-fluoropyridin-3-amine
CID 130104000
5-(aminomethyl)-6-(difluoromethyl)-4-fluoropyridine-3-carbonitrile
CID 130076050
[2-(difluoromethyl)-5-fluoro-3-methyl-4-pyridinyl]methanamine
CID 130080922
2-(difluoromethyl)-3,5-difluoropyridin-4-amine
CID 118812171
4-(bromomethyl)-6-(difluoromethyl)-5-methylpyridin-3-amine
CID 130106337
2-[5-amino-3-(chloromethyl)-2-(difluoromethyl)-4-pyridinyl]acetic acid
CID 130107704
[4,5-diamino-2-(difluoromethyl)-3-pyridinyl]methanol
CID 118818389
6-(difluoromethyl)-5-fluoro-4-(hydroxymethyl)pyridin-3-ol
CID 130079568
5-(aminomethyl)-4-(difluoromethyl)-6-iodopyridin-3-amine
CID 130105277

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine?
The IUPAC name of 4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine (CID 130103996) is 4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine.
What is the SMILES notation for 4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine?
The canonical SMILES for 4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine is NCc1c(N)cnc(C(F)F)c1F.
What is the InChIKey of 4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine?
The InChIKey is GPAZZRVRHHXQHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3N3/c8-5-3(1-11)4(12)2-13-6(5)7(9)10/h2,7H,1,11-12H2.
What are the key properties of 4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine?
4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine has a molecular weight of 191.16 g/mol, XLogP of 1.20, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-6-(difluoromethyl)-5-fluoropyridin-3-amine is sourced from PubChem (CID 130103996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).