6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide

C12H13N3O2S — CID 170574699

IUPAC6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide
SMILESCCc1cc(-c2cnc(OC)s2)cc(C(N)=O)n1
InChIInChI=1S/C12H13N3O2S/c1-3-8-4-7(5-9(15-8)11(13)16)10-6-14-12(17-2)18-10/h4-6H,3H2,1-2H3,(H2,13,16)
InChIKeyIYESYPYYDQFANY-UHFFFAOYSA-N
MW263.32 g/mol
LogP1.88
Rot. Bonds4

About 6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide

6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide (PubChem CID 170574699) has the molecular formula C12H13N3O2S and a molecular weight of 263.32 g/mol. Its IUPAC name is 6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide
PubChem CID170574699
Molecular FormulaC12H13N3O2S
Molecular Weight263.32 g/mol
Exact Mass263.07
IUPAC Name6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide
SMILESCCc1cc(-c2cnc(OC)s2)cc(C(N)=O)n1
InChIInChI=1S/C12H13N3O2S/c1-3-8-4-7(5-9(15-8)11(13)16)10-6-14-12(17-2)18-10/h4-6H,3H2,1-2H3,(H2,13,16)
InChIKeyIYESYPYYDQFANY-UHFFFAOYSA-N
XLogP1.88
TPSA78.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide?
The IUPAC name of 6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide (CID 170574699) is 6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide is CCc1cc(-c2cnc(OC)s2)cc(C(N)=O)n1.
What is the InChIKey of 6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide?
The InChIKey is IYESYPYYDQFANY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2S/c1-3-8-4-7(5-9(15-8)11(13)16)10-6-14-12(17-2)18-10/h4-6H,3H2,1-2H3,(H2,13,16).
What are the key properties of 6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide?
6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide has a molecular weight of 263.32 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4-(2-methoxy-1,3-thiazol-5-yl)pyridine-2-carboxamide is sourced from PubChem (CID 170574699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).