N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide

C15H10N4OS2 — CID 122691007

IUPACN-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide
SMILESCc1csc(C(=O)Nc2nc(-c3ccccn3)c(C#N)s2)c1
InChIInChI=1S/C15H10N4OS2/c1-9-6-11(21-8-9)14(20)19-15-18-13(12(7-16)22-15)10-4-2-3-5-17-10/h2-6,8H,1H3,(H,18,19,20)
InChIKeyLVPLGLUURRBPBW-UHFFFAOYSA-N
MW326.41 g/mol
LogP3.70
Rot. Bonds3

About N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide

N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide (PubChem CID 122691007) has the molecular formula C15H10N4OS2 and a molecular weight of 326.41 g/mol. Its IUPAC name is N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide
PubChem CID122691007
Molecular FormulaC15H10N4OS2
Molecular Weight326.41 g/mol
Exact Mass326.03
IUPAC NameN-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide
SMILESCc1csc(C(=O)Nc2nc(-c3ccccn3)c(C#N)s2)c1
InChIInChI=1S/C15H10N4OS2/c1-9-6-11(21-8-9)14(20)19-15-18-13(12(7-16)22-15)10-4-2-3-5-17-10/h2-6,8H,1H3,(H,18,19,20)
InChIKeyLVPLGLUURRBPBW-UHFFFAOYSA-N
XLogP3.70
TPSA78.67 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.41
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(5-amino-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide
CID 145187781
N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)benzamide
CID 122690848
N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-3-pyrimidin-5-yltriazole-4-carboxamide
CID 176858944
N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-2-methoxy-4-(trifluoromethoxy)benzamide
CID 122691018
3-[(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 87302475
N-[5-cyano-4-(6-methyl-2-pyridinyl)-1,3-thiazol-2-yl]-3-pyridin-2-ylimidazole-4-carboxamide
CID 176859505
2-[(4-methylthiophene-2-carbonyl)amino]-1,3-benzothiazole-6-carboxylic acid
CID 166127667
4-methyl-N-[2-(3-pyridin-2-ylpyrazol-1-yl)ethyl]thiophene-2-carboxamide
CID 90588269
4-methyl-N-[(1-methyl-5-pyridin-2-ylpyrazol-3-yl)methyl]thiophene-2-carboxamide
CID 90555587
N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 8928359
2-(2,5-dimethylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
CID 2660521
N-(1,3-benzothiazol-2-yl)-4-sulfanylthiophene-2-carboxamide
CID 107021690

Frequently Asked Questions

What is the IUPAC name of N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide?
The IUPAC name of N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide (CID 122691007) is N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide.
What is the SMILES notation for N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide?
The canonical SMILES for N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide is Cc1csc(C(=O)Nc2nc(-c3ccccn3)c(C#N)s2)c1.
What is the InChIKey of N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide?
The InChIKey is LVPLGLUURRBPBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4OS2/c1-9-6-11(21-8-9)14(20)19-15-18-13(12(7-16)22-15)10-4-2-3-5-17-10/h2-6,8H,1H3,(H,18,19,20).
What are the key properties of N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide?
N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide has a molecular weight of 326.41 g/mol, XLogP of 3.70, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyano-4-pyridin-2-yl-1,3-thiazol-2-yl)-4-methylthiophene-2-carboxamide is sourced from PubChem (CID 122691007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).