6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide

C15H12N4OS — CID 18151055

IUPAC6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2nc(-c3cccnc3)cs2)cn1
InChIInChI=1S/C15H12N4OS/c1-10-4-5-12(8-17-10)14(20)19-15-18-13(9-21-15)11-3-2-6-16-7-11/h2-9H,1H3,(H,18,19,20)
InChIKeyPDFJUXSLYWWZBG-UHFFFAOYSA-N
MW296.36 g/mol
LogP3.16
Rot. Bonds3

About 6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide

6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide (PubChem CID 18151055) has the molecular formula C15H12N4OS and a molecular weight of 296.36 g/mol. Its IUPAC name is 6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
PubChem CID18151055
Molecular FormulaC15H12N4OS
Molecular Weight296.36 g/mol
Exact Mass296.07
IUPAC Name6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2nc(-c3cccnc3)cs2)cn1
InChIInChI=1S/C15H12N4OS/c1-10-4-5-12(8-17-10)14(20)19-15-18-13(9-21-15)11-3-2-6-16-7-11/h2-9H,1H3,(H,18,19,20)
InChIKeyPDFJUXSLYWWZBG-UHFFFAOYSA-N
XLogP3.16
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.36
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
The IUPAC name of 6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide (CID 18151055) is 6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide is Cc1ccc(C(=O)Nc2nc(-c3cccnc3)cs2)cn1.
What is the InChIKey of 6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
The InChIKey is PDFJUXSLYWWZBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4OS/c1-10-4-5-12(8-17-10)14(20)19-15-18-13(9-21-15)11-3-2-6-16-7-11/h2-9H,1H3,(H,18,19,20).
What are the key properties of 6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide has a molecular weight of 296.36 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 18151055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).