N-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide

C13H10N6OS — CID 654102

IUPACN-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide
SMILESCN(C(=O)c1ccccn1)c1nnc(-c2cnccn2)s1
InChIInChI=1S/C13H10N6OS/c1-19(12(20)9-4-2-3-5-15-9)13-18-17-11(21-13)10-8-14-6-7-16-10/h2-8H,1H3
InChIKeyUSRISRUSPXJLQG-UHFFFAOYSA-N
MW298.33 g/mol
LogP1.67
Rot. Bonds3

About N-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide

N-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide (PubChem CID 654102) has the molecular formula C13H10N6OS and a molecular weight of 298.33 g/mol. Its IUPAC name is N-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide
PubChem CID654102
Molecular FormulaC13H10N6OS
Molecular Weight298.33 g/mol
Exact Mass298.06
IUPAC NameN-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide
SMILESCN(C(=O)c1ccccn1)c1nnc(-c2cnccn2)s1
InChIInChI=1S/C13H10N6OS/c1-19(12(20)9-4-2-3-5-15-9)13-18-17-11(21-13)10-8-14-6-7-16-10/h2-8H,1H3
InChIKeyUSRISRUSPXJLQG-UHFFFAOYSA-N
XLogP1.67
TPSA84.76 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.33
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide?
The IUPAC name of N-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide (CID 654102) is N-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide?
The canonical SMILES for N-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide is CN(C(=O)c1ccccn1)c1nnc(-c2cnccn2)s1.
What is the InChIKey of N-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide?
The InChIKey is USRISRUSPXJLQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N6OS/c1-19(12(20)9-4-2-3-5-15-9)13-18-17-11(21-13)10-8-14-6-7-16-10/h2-8H,1H3.
What are the key properties of N-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide?
N-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide has a molecular weight of 298.33 g/mol, XLogP of 1.67, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 654102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).