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

C11H12N4O2S — CID 2442210

IUPAC2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)Nc1nnc(C)s1
InChIInChI=1S/C11H12N4O2S/c1-3-17-10-8(5-4-6-12-10)9(16)13-11-15-14-7(2)18-11/h4-6H,3H2,1-2H3,(H,13,15,16)
InChIKeyRTGZKIAFOIOIIQ-UHFFFAOYSA-N
MW264.31 g/mol
LogP1.89
Rot. Bonds4

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

2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide (PubChem CID 2442210) has the molecular formula C11H12N4O2S and a molecular weight of 264.31 g/mol. Its IUPAC name is 2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
PubChem CID2442210
Molecular FormulaC11H12N4O2S
Molecular Weight264.31 g/mol
Exact Mass264.07
IUPAC Name2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)Nc1nnc(C)s1
InChIInChI=1S/C11H12N4O2S/c1-3-17-10-8(5-4-6-12-10)9(16)13-11-15-14-7(2)18-11/h4-6H,3H2,1-2H3,(H,13,15,16)
InChIKeyRTGZKIAFOIOIIQ-UHFFFAOYSA-N
XLogP1.89
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide?
The IUPAC name of 2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide (CID 2442210) is 2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide is CCOc1ncccc1C(=O)Nc1nnc(C)s1.
What is the InChIKey of 2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide?
The InChIKey is RTGZKIAFOIOIIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2S/c1-3-17-10-8(5-4-6-12-10)9(16)13-11-15-14-7(2)18-11/h4-6H,3H2,1-2H3,(H,13,15,16).
What are the key properties of 2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide?
2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide has a molecular weight of 264.31 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 2442210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).