8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine

C7H11FN4 — CID 170032463

IUPAC8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
SMILESCc1nc2n(n1)CC(N)CC2F
InChIInChI=1S/C7H11FN4/c1-4-10-7-6(8)2-5(9)3-12(7)11-4/h5-6H,2-3,9H2,1H3
InChIKeySNPIJIDLJLWCAI-UHFFFAOYSA-N
MW170.19 g/mol
LogP0.33
Rot. Bonds

About 8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine

8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine (PubChem CID 170032463) has the molecular formula C7H11FN4 and a molecular weight of 170.19 g/mol. Its IUPAC name is 8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine.

Molecular Properties

Compound Name8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
PubChem CID170032463
Molecular FormulaC7H11FN4
Molecular Weight170.19 g/mol
Exact Mass170.10
IUPAC Name8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
SMILESCc1nc2n(n1)CC(N)CC2F
InChIInChI=1S/C7H11FN4/c1-4-10-7-6(8)2-5(9)3-12(7)11-4/h5-6H,2-3,9H2,1H3
InChIKeySNPIJIDLJLWCAI-UHFFFAOYSA-N
XLogP0.33
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.19
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
The IUPAC name of 8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine (CID 170032463) is 8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine.
What is the SMILES notation for 8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
The canonical SMILES for 8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine is Cc1nc2n(n1)CC(N)CC2F.
What is the InChIKey of 8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
The InChIKey is SNPIJIDLJLWCAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11FN4/c1-4-10-7-6(8)2-5(9)3-12(7)11-4/h5-6H,2-3,9H2,1H3.
What are the key properties of 8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine has a molecular weight of 170.19 g/mol, XLogP of 0.33, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine is sourced from PubChem (CID 170032463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).