5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide

C12H14N6O — CID 75484192

IUPAC5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide
SMILESCc1cnc(C(=O)Nc2nnc3n2CCCC3)cn1
InChIInChI=1S/C12H14N6O/c1-8-6-14-9(7-13-8)11(19)15-12-17-16-10-4-2-3-5-18(10)12/h6-7H,2-5H2,1H3,(H,15,17,19)
InChIKeyKZONYEVZGCOMPP-UHFFFAOYSA-N
MW258.28 g/mol
LogP0.97
Rot. Bonds2

About 5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide

5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide (PubChem CID 75484192) has the molecular formula C12H14N6O and a molecular weight of 258.28 g/mol. Its IUPAC name is 5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide
PubChem CID75484192
Molecular FormulaC12H14N6O
Molecular Weight258.28 g/mol
Exact Mass258.12
IUPAC Name5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide
SMILESCc1cnc(C(=O)Nc2nnc3n2CCCC3)cn1
InChIInChI=1S/C12H14N6O/c1-8-6-14-9(7-13-8)11(19)15-12-17-16-10-4-2-3-5-18(10)12/h6-7H,2-5H2,1H3,(H,15,17,19)
InChIKeyKZONYEVZGCOMPP-UHFFFAOYSA-N
XLogP0.97
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide?
The IUPAC name of 5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide (CID 75484192) is 5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide?
The canonical SMILES for 5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide is Cc1cnc(C(=O)Nc2nnc3n2CCCC3)cn1.
What is the InChIKey of 5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide?
The InChIKey is KZONYEVZGCOMPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6O/c1-8-6-14-9(7-13-8)11(19)15-12-17-16-10-4-2-3-5-18(10)12/h6-7H,2-5H2,1H3,(H,15,17,19).
What are the key properties of 5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide?
5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 0.97, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 75484192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).