4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide

C18H14N6OS — CID 146710066

IUPAC4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide
SMILESCc1nc(-c2ccccn2)sc1C(=O)NC1=NN=C(c2ccccn2)C1
InChIInChI=1S/C18H14N6OS/c1-11-16(26-18(21-11)13-7-3-5-9-20-13)17(25)22-15-10-14(23-24-15)12-6-2-4-8-19-12/h2-9H,10H2,1H3,(H,22,24,25)
InChIKeyRBHPJRWSHUOIOY-UHFFFAOYSA-N
MW362.42 g/mol
LogP2.84
Rot. Bonds3

About 4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide

4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide (PubChem CID 146710066) has the molecular formula C18H14N6OS and a molecular weight of 362.42 g/mol. Its IUPAC name is 4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide
PubChem CID146710066
Molecular FormulaC18H14N6OS
Molecular Weight362.42 g/mol
Exact Mass362.09
IUPAC Name4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide
SMILESCc1nc(-c2ccccn2)sc1C(=O)NC1=NN=C(c2ccccn2)C1
InChIInChI=1S/C18H14N6OS/c1-11-16(26-18(21-11)13-7-3-5-9-20-13)17(25)22-15-10-14(23-24-15)12-6-2-4-8-19-12/h2-9H,10H2,1H3,(H,22,24,25)
InChIKeyRBHPJRWSHUOIOY-UHFFFAOYSA-N
XLogP2.84
TPSA92.49 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.42
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide (CID 146710066) is 4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide is Cc1nc(-c2ccccn2)sc1C(=O)NC1=NN=C(c2ccccn2)C1.
What is the InChIKey of 4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide?
The InChIKey is RBHPJRWSHUOIOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N6OS/c1-11-16(26-18(21-11)13-7-3-5-9-20-13)17(25)22-15-10-14(23-24-15)12-6-2-4-8-19-12/h2-9H,10H2,1H3,(H,22,24,25).
What are the key properties of 4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide?
4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide has a molecular weight of 362.42 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 146710066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).