N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide

C15H12N4OS — CID 18090488

IUPACN-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide
SMILESCc1nc(-c2ccc(NC(=O)c3cnccn3)cc2)cs1
InChIInChI=1S/C15H12N4OS/c1-10-18-14(9-21-10)11-2-4-12(5-3-11)19-15(20)13-8-16-6-7-17-13/h2-9H,1H3,(H,19,20)
InChIKeyANKGSYSYBCXWDQ-UHFFFAOYSA-N
MW296.36 g/mol
LogP3.16
Rot. Bonds3

About N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide

N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide (PubChem CID 18090488) has the molecular formula C15H12N4OS and a molecular weight of 296.36 g/mol. Its IUPAC name is N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide
PubChem CID18090488
Molecular FormulaC15H12N4OS
Molecular Weight296.36 g/mol
Exact Mass296.07
IUPAC NameN-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide
SMILESCc1nc(-c2ccc(NC(=O)c3cnccn3)cc2)cs1
InChIInChI=1S/C15H12N4OS/c1-10-18-14(9-21-10)11-2-4-12(5-3-11)19-15(20)13-8-16-6-7-17-13/h2-9H,1H3,(H,19,20)
InChIKeyANKGSYSYBCXWDQ-UHFFFAOYSA-N
XLogP3.16
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.36
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-pyridin-2-ylphenyl)pyrazine-2-carboxamide
CID 110461757
4-acetamido-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 27167057
N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazine-2-carboxamide
CID 110443762
4-iodo-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 27167049
methyl N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]carbamate
CID 108727310
5-chloro-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,3,4-thiadiazole-2-carboxamide
CID 80619296
N-(4-acetylphenyl)pyrazine-2-carboxamide
CID 803592
N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 24532559
5-cyclopropyl-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2-oxazole-3-carboxamide
CID 122286600
4-(dimethylamino)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 108727305
N-(4-sulfanylphenyl)pyrazine-2-carboxamide
CID 137223268
N-(4-aminophenyl)pyrazine-2-carboxamide
CID 16775114

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide?
The IUPAC name of N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide (CID 18090488) is N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide is Cc1nc(-c2ccc(NC(=O)c3cnccn3)cc2)cs1.
What is the InChIKey of N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide?
The InChIKey is ANKGSYSYBCXWDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4OS/c1-10-18-14(9-21-10)11-2-4-12(5-3-11)19-15(20)13-8-16-6-7-17-13/h2-9H,1H3,(H,19,20).
What are the key properties of N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide?
N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide has a molecular weight of 296.36 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazine-2-carboxamide is sourced from PubChem (CID 18090488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).