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

C10H9N3OS — CID 1483696

IUPACN-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide
SMILESCNC(=O)c1csc(-c2ccncc2)n1
InChIInChI=1S/C10H9N3OS/c1-11-9(14)8-6-15-10(13-8)7-2-4-12-5-3-7/h2-6H,1H3,(H,11,14)
InChIKeyANRNYGXDGQPCFT-UHFFFAOYSA-N
MW219.27 g/mol
LogP1.56
Rot. Bonds2

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

N-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide (PubChem CID 1483696) has the molecular formula C10H9N3OS and a molecular weight of 219.27 g/mol. Its IUPAC name is N-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide
PubChem CID1483696
Molecular FormulaC10H9N3OS
Molecular Weight219.27 g/mol
Exact Mass219.05
IUPAC NameN-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide
SMILESCNC(=O)c1csc(-c2ccncc2)n1
InChIInChI=1S/C10H9N3OS/c1-11-9(14)8-6-15-10(13-8)7-2-4-12-5-3-7/h2-6H,1H3,(H,11,14)
InChIKeyANRNYGXDGQPCFT-UHFFFAOYSA-N
XLogP1.56
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.27
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide (CID 1483696) is N-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide is CNC(=O)c1csc(-c2ccncc2)n1.
What is the InChIKey of N-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide?
The InChIKey is ANRNYGXDGQPCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3OS/c1-11-9(14)8-6-15-10(13-8)7-2-4-12-5-3-7/h2-6H,1H3,(H,11,14).
What are the key properties of N-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide?
N-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide has a molecular weight of 219.27 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 1483696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).