2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide

C13H10N4OS2 — CID 71880407

IUPAC2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide
SMILESCc1nc(-c2ccsc2)ccc1C(=O)Nc1nncs1
InChIInChI=1S/C13H10N4OS2/c1-8-10(12(18)16-13-17-14-7-20-13)2-3-11(15-8)9-4-5-19-6-9/h2-7H,1H3,(H,16,17,18)
InChIKeyGJTIPAZNNAHCBT-UHFFFAOYSA-N
MW302.38 g/mol
LogP3.22
Rot. Bonds3

About 2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide

2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide (PubChem CID 71880407) has the molecular formula C13H10N4OS2 and a molecular weight of 302.38 g/mol. Its IUPAC name is 2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide
PubChem CID71880407
Molecular FormulaC13H10N4OS2
Molecular Weight302.38 g/mol
Exact Mass302.03
IUPAC Name2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide
SMILESCc1nc(-c2ccsc2)ccc1C(=O)Nc1nncs1
InChIInChI=1S/C13H10N4OS2/c1-8-10(12(18)16-13-17-14-7-20-13)2-3-11(15-8)9-4-5-19-6-9/h2-7H,1H3,(H,16,17,18)
InChIKeyGJTIPAZNNAHCBT-UHFFFAOYSA-N
XLogP3.22
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide (CID 71880407) is 2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide is Cc1nc(-c2ccsc2)ccc1C(=O)Nc1nncs1.
What is the InChIKey of 2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide?
The InChIKey is GJTIPAZNNAHCBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4OS2/c1-8-10(12(18)16-13-17-14-7-20-13)2-3-11(15-8)9-4-5-19-6-9/h2-7H,1H3,(H,16,17,18).
What are the key properties of 2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide?
2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide has a molecular weight of 302.38 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylpyridine-3-carboxamide is sourced from PubChem (CID 71880407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).