N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide

C14H11N5O2S — CID 51038395

IUPACN-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide
SMILESCc1csc(NC(=O)c2cc(Oc3cncnc3)ccn2)n1
InChIInChI=1S/C14H11N5O2S/c1-9-7-22-14(18-9)19-13(20)12-4-10(2-3-17-12)21-11-5-15-8-16-6-11/h2-8H,1H3,(H,18,19,20)
InChIKeyHQSAJPPYHDESIU-UHFFFAOYSA-N
MW313.34 g/mol
LogP2.68
Rot. Bonds4

About N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide

N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide (PubChem CID 51038395) has the molecular formula C14H11N5O2S and a molecular weight of 313.34 g/mol. Its IUPAC name is N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide
PubChem CID51038395
Molecular FormulaC14H11N5O2S
Molecular Weight313.34 g/mol
Exact Mass313.06
IUPAC NameN-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide
SMILESCc1csc(NC(=O)c2cc(Oc3cncnc3)ccn2)n1
InChIInChI=1S/C14H11N5O2S/c1-9-7-22-14(18-9)19-13(20)12-4-10(2-3-17-12)21-11-5-15-8-16-6-11/h2-8H,1H3,(H,18,19,20)
InChIKeyHQSAJPPYHDESIU-UHFFFAOYSA-N
XLogP2.68
TPSA89.89 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.34
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide?
The IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide (CID 51038395) is N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide.
What is the SMILES notation for N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide?
The canonical SMILES for N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide is Cc1csc(NC(=O)c2cc(Oc3cncnc3)ccn2)n1.
What is the InChIKey of N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide?
The InChIKey is HQSAJPPYHDESIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N5O2S/c1-9-7-22-14(18-9)19-13(20)12-4-10(2-3-17-12)21-11-5-15-8-16-6-11/h2-8H,1H3,(H,18,19,20).
What are the key properties of N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide?
N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide has a molecular weight of 313.34 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-yloxypyridine-2-carboxamide is sourced from PubChem (CID 51038395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).