N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide

C18H14N6O2S — CID 164548251

IUPACN-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide
SMILESCc1ncc(C(N)=O)cc1NC(=O)c1cnn2cc(-c3ccncc3)sc12
InChIInChI=1S/C18H14N6O2S/c1-10-14(6-12(7-21-10)16(19)25)23-17(26)13-8-22-24-9-15(27-18(13)24)11-2-4-20-5-3-11/h2-9H,1H3,(H2,19,25)(H,23,26)
InChIKeyOJWXUKWLAQVXIL-UHFFFAOYSA-N
MW378.42 g/mol
LogP2.51
Rot. Bonds4

About N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide

N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide (PubChem CID 164548251) has the molecular formula C18H14N6O2S and a molecular weight of 378.42 g/mol. Its IUPAC name is N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide.

Molecular Properties

Compound NameN-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide
PubChem CID164548251
Molecular FormulaC18H14N6O2S
Molecular Weight378.42 g/mol
Exact Mass378.09
IUPAC NameN-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide
SMILESCc1ncc(C(N)=O)cc1NC(=O)c1cnn2cc(-c3ccncc3)sc12
InChIInChI=1S/C18H14N6O2S/c1-10-14(6-12(7-21-10)16(19)25)23-17(26)13-8-22-24-9-15(27-18(13)24)11-2-4-20-5-3-11/h2-9H,1H3,(H2,19,25)(H,23,26)
InChIKeyOJWXUKWLAQVXIL-UHFFFAOYSA-N
XLogP2.51
TPSA115.27 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.42
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-3-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide
CID 164547502
N-[5-[2-(3,3-dimethylazetidin-1-yl)ethylcarbamoyl]-2-methyl-3-pyridinyl]-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide
CID 164547960
N-[5-[2-(3,3-difluoroazetidin-1-yl)ethylcarbamoyl]-2-methyl-3-pyridinyl]-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide;molecular hydrogen
CID 164547748
N-[5-[2-(5-azaspiro[2.4]heptan-5-yl)ethylcarbamoyl]-2-methyl-3-pyridinyl]-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide;molecular hydrogen
CID 164547887
N-[2-methyl-5-(methylcarbamoyl)-3-pyridinyl]-2-(1-methylpyrazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide
CID 164547259
ethyl 6-methyl-5-[[2-(1-methylpyrazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carbonyl]amino]pyridine-3-carboxylate
CID 164548132
6-methyl-5-[[2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carbonyl]amino]pyridine-3-carboxylic acid
CID 164547893
1-(2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazol-7-yl)ethanone
CID 164547082
N-[5-[[2-(1,3-dihydropyrrolo[3,4-c]pyridin-2-yl)acetyl]amino]-2-methyl-3-pyridinyl]-2-(1-methylpyrazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide
CID 164548250
N-[5-[2-(2-hydroxyethylamino)ethylcarbamoyl]-2-methyl-3-pyridinyl]-2-(1-methylpyrazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide;hydrochloride
CID 164547713
N-(2,5-dimethyl-3-pyridinyl)-2-(1-methylindazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide
CID 167138727
N-[5-[2-(2,2-dimethylpyrrolidin-1-yl)ethylcarbamoyl]-2-methyl-3-pyridinyl]-2-pyrimidin-5-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide
CID 164547126

Frequently Asked Questions

What is the IUPAC name of N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide?
The IUPAC name of N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide (CID 164548251) is N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide.
What is the SMILES notation for N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide?
The canonical SMILES for N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide is Cc1ncc(C(N)=O)cc1NC(=O)c1cnn2cc(-c3ccncc3)sc12.
What is the InChIKey of N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide?
The InChIKey is OJWXUKWLAQVXIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N6O2S/c1-10-14(6-12(7-21-10)16(19)25)23-17(26)13-8-22-24-9-15(27-18(13)24)11-2-4-20-5-3-11/h2-9H,1H3,(H2,19,25)(H,23,26).
What are the key properties of N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide?
N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide has a molecular weight of 378.42 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-carbamoyl-2-methyl-3-pyridinyl)-2-pyridin-4-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxamide is sourced from PubChem (CID 164548251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).