2-pyridin-4-yl-1,3-thiazole-4-carboxamide

C9H7N3OS — CID 2824500

IUPAC2-pyridin-4-yl-1,3-thiazole-4-carboxamide
SMILESNC(=O)c1csc(-c2ccncc2)n1
InChIInChI=1S/C9H7N3OS/c10-8(13)7-5-14-9(12-7)6-1-3-11-4-2-6/h1-5H,(H2,10,13)
InChIKeyKWUBEXCPIQGXBL-UHFFFAOYSA-N
MW205.24 g/mol
LogP1.30
Rot. Bonds2

About 2-pyridin-4-yl-1,3-thiazole-4-carboxamide

2-pyridin-4-yl-1,3-thiazole-4-carboxamide (PubChem CID 2824500) has the molecular formula C9H7N3OS and a molecular weight of 205.24 g/mol. Its IUPAC name is 2-pyridin-4-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-pyridin-4-yl-1,3-thiazole-4-carboxamide
PubChem CID2824500
Molecular FormulaC9H7N3OS
Molecular Weight205.24 g/mol
Exact Mass205.03
IUPAC Name2-pyridin-4-yl-1,3-thiazole-4-carboxamide
SMILESNC(=O)c1csc(-c2ccncc2)n1
InChIInChI=1S/C9H7N3OS/c10-8(13)7-5-14-9(12-7)6-1-3-11-4-2-6/h1-5H,(H2,10,13)
InChIKeyKWUBEXCPIQGXBL-UHFFFAOYSA-N
XLogP1.30
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.24
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N4-benzyl-2-(3-pyridyl)-1,3-thiazole-4-carboxamide
CID 2824333
N-(2-chlorophenyl)-2-pyridin-3-yl-1,3-thiazole-4-carboxamide
CID 2824236
2-(Pyridin-4-yl)-1,3-thiazole-4-carboxylic acid
CID 716091
2-Pyridin-3-yl-1,3-thiazole-4-carboxamide, N-hydroxy-
CID 604917
(E)-3-[2-(2-methyl-4-thiazolyl)vinyl]pyridine
CID 11715388
N4-(4-chlorobenzyl)-2-(3-pyridyl)-1,3-thiazole-4-carboxamide
CID 2824334
N-(4-chlorophenyl)-2-(4-pyridinyl)-1,3-thiazole-4-carboxamide
CID 1483683
2-(4-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxamide
CID 1483697
N-(2,4-difluorophenyl)-2-(4-pyridinyl)-1,3-thiazole-4-carboxamide
CID 1483698
N-(4-bromophenyl)-2-(4-pyridinyl)-1,3-thiazole-4-carboxamide
CID 1483711
4-Methyl-2-(3-pyridinyl)-1,3-thiazole-5-carboxamide
CID 1483714
N-(3-cyanothiophen-2-yl)picolinamide
CID 2525612

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-4-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-pyridin-4-yl-1,3-thiazole-4-carboxamide (CID 2824500) is 2-pyridin-4-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-pyridin-4-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-pyridin-4-yl-1,3-thiazole-4-carboxamide is NC(=O)c1csc(-c2ccncc2)n1.
What is the InChIKey of 2-pyridin-4-yl-1,3-thiazole-4-carboxamide?
The InChIKey is KWUBEXCPIQGXBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N3OS/c10-8(13)7-5-14-9(12-7)6-1-3-11-4-2-6/h1-5H,(H2,10,13).
What are the key properties of 2-pyridin-4-yl-1,3-thiazole-4-carboxamide?
2-pyridin-4-yl-1,3-thiazole-4-carboxamide has a molecular weight of 205.24 g/mol, XLogP of 1.30, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-4-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 2824500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).