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

C13H10N4OS2 — CID 59580621

IUPACN-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide
SMILESCc1nc(-c2cccnc2)sc1NC(=O)c1ccns1
InChIInChI=1S/C13H10N4OS2/c1-8-12(17-11(18)10-4-6-15-20-10)19-13(16-8)9-3-2-5-14-7-9/h2-7H,1H3,(H,17,18)
InChIKeyLEXXTSHDGCQROK-UHFFFAOYSA-N
MW302.38 g/mol
LogP3.22
Rot. Bonds3

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

N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide (PubChem CID 59580621) has the molecular formula C13H10N4OS2 and a molecular weight of 302.38 g/mol. Its IUPAC name is N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide
PubChem CID59580621
Molecular FormulaC13H10N4OS2
Molecular Weight302.38 g/mol
Exact Mass302.03
IUPAC NameN-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide
SMILESCc1nc(-c2cccnc2)sc1NC(=O)c1ccns1
InChIInChI=1S/C13H10N4OS2/c1-8-12(17-11(18)10-4-6-15-20-10)19-13(16-8)9-3-2-5-14-7-9/h2-7H,1H3,(H,17,18)
InChIKeyLEXXTSHDGCQROK-UHFFFAOYSA-N
XLogP3.22
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-chloro-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide
CID 89445696
N,4-dimethyl-2-pyridin-3-yl-1,3-thiazol-5-amine
CID 59580850
2,2-dimethyl-N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-4-oxo-3H-pyran-6-carboxamide
CID 59580781
N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-3-methylsulfonylpropanamide
CID 59580935
3-(difluoromethylsulfanyl)-N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)benzamide
CID 59580977
N-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-2-pyridin-3-ylacetamide
CID 75503297
2,2-dimethyl-N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-3-methylsulfinylpropanamide
CID 59580614
(1-methylcyclohexyl) N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)carbamate
CID 59580446
1-formyl-N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)azetidine-2-carboxamide
CID 126635303
4-methyl-2-pyridin-3-yl-N-(1-pyrimidin-2-ylethyl)-1,3-thiazole-5-carboxamide
CID 58236230
4-methyl-N-(2-methyl-6-propan-2-ylphenyl)-2-pyridin-3-yl-1,3-thiazole-5-carboxamide
CID 30134184
N-methyl-1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethanamine
CID 61287607

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide?
The IUPAC name of N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide (CID 59580621) is N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide.
What is the SMILES notation for N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide?
The canonical SMILES for N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide is Cc1nc(-c2cccnc2)sc1NC(=O)c1ccns1.
What is the InChIKey of N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide?
The InChIKey is LEXXTSHDGCQROK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4OS2/c1-8-12(17-11(18)10-4-6-15-20-10)19-13(16-8)9-3-2-5-14-7-9/h2-7H,1H3,(H,17,18).
What are the key properties of N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide?
N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide has a molecular weight of 302.38 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,2-thiazole-5-carboxamide is sourced from PubChem (CID 59580621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).