8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine

C9H11FN4 — CID 176741427

IUPAC8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCc1nc2c(F)nc(C(C)C)cn2n1
InChIInChI=1S/C9H11FN4/c1-5(2)7-4-14-9(8(10)12-7)11-6(3)13-14/h4-5H,1-3H3
InChIKeyKNMDEQUKNOVRTC-UHFFFAOYSA-N
MW194.21 g/mol
LogP1.70
Rot. Bonds1

About 8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine

8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine (PubChem CID 176741427) has the molecular formula C9H11FN4 and a molecular weight of 194.21 g/mol. Its IUPAC name is 8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine
PubChem CID176741427
Molecular FormulaC9H11FN4
Molecular Weight194.21 g/mol
Exact Mass194.10
IUPAC Name8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCc1nc2c(F)nc(C(C)C)cn2n1
InChIInChI=1S/C9H11FN4/c1-5(2)7-4-14-9(8(10)12-7)11-6(3)13-14/h4-5H,1-3H3
InChIKeyKNMDEQUKNOVRTC-UHFFFAOYSA-N
XLogP1.70
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.21
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine?
The IUPAC name of 8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine (CID 176741427) is 8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine.
What is the SMILES notation for 8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine?
The canonical SMILES for 8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine is Cc1nc2c(F)nc(C(C)C)cn2n1.
What is the InChIKey of 8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine?
The InChIKey is KNMDEQUKNOVRTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN4/c1-5(2)7-4-14-9(8(10)12-7)11-6(3)13-14/h4-5H,1-3H3.
What are the key properties of 8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine?
8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine has a molecular weight of 194.21 g/mol, XLogP of 1.70, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-2-methyl-6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine is sourced from PubChem (CID 176741427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).