N,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide

C8H9N5O2 — CID 91891361

IUPACN,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide
SMILESCNC(=O)c1nnn2cc(C)[nH]c(=O)c12
InChIInChI=1S/C8H9N5O2/c1-4-3-13-6(8(15)10-4)5(11-12-13)7(14)9-2/h3H,1-2H3,(H,9,14)(H,10,15)
InChIKeyAVRNNGJCJFDNLH-UHFFFAOYSA-N
MW207.19 g/mol
LogP-0.91
Rot. Bonds1

About N,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide

N,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide (PubChem CID 91891361) has the molecular formula C8H9N5O2 and a molecular weight of 207.19 g/mol. Its IUPAC name is N,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide.

Molecular Properties

Compound NameN,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide
PubChem CID91891361
Molecular FormulaC8H9N5O2
Molecular Weight207.19 g/mol
Exact Mass207.08
IUPAC NameN,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide
SMILESCNC(=O)c1nnn2cc(C)[nH]c(=O)c12
InChIInChI=1S/C8H9N5O2/c1-4-3-13-6(8(15)10-4)5(11-12-13)7(14)9-2/h3H,1-2H3,(H,9,14)(H,10,15)
InChIKeyAVRNNGJCJFDNLH-UHFFFAOYSA-N
XLogP-0.91
TPSA92.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.19
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide?
The IUPAC name of N,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide (CID 91891361) is N,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide.
What is the SMILES notation for N,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide?
The canonical SMILES for N,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide is CNC(=O)c1nnn2cc(C)[nH]c(=O)c12.
What is the InChIKey of N,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide?
The InChIKey is AVRNNGJCJFDNLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5O2/c1-4-3-13-6(8(15)10-4)5(11-12-13)7(14)9-2/h3H,1-2H3,(H,9,14)(H,10,15).
What are the key properties of N,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide?
N,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide has a molecular weight of 207.19 g/mol, XLogP of -0.91, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide is sourced from PubChem (CID 91891361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).