6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide

C12H15N5OS — CID 170511217

IUPAC6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide
SMILESCC(C)(C)c1csc(Nc2cncc(C(N)=O)n2)n1
InChIInChI=1S/C12H15N5OS/c1-12(2,3)8-6-19-11(16-8)17-9-5-14-4-7(15-9)10(13)18/h4-6H,1-3H3,(H2,13,18)(H,15,16,17)
InChIKeyWVAHQCPBZYLNSL-UHFFFAOYSA-N
MW277.35 g/mol
LogP2.07
Rot. Bonds3

About 6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide

6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide (PubChem CID 170511217) has the molecular formula C12H15N5OS and a molecular weight of 277.35 g/mol. Its IUPAC name is 6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide
PubChem CID170511217
Molecular FormulaC12H15N5OS
Molecular Weight277.35 g/mol
Exact Mass277.10
IUPAC Name6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide
SMILESCC(C)(C)c1csc(Nc2cncc(C(N)=O)n2)n1
InChIInChI=1S/C12H15N5OS/c1-12(2,3)8-6-19-11(16-8)17-9-5-14-4-7(15-9)10(13)18/h4-6H,1-3H3,(H2,13,18)(H,15,16,17)
InChIKeyWVAHQCPBZYLNSL-UHFFFAOYSA-N
XLogP2.07
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyridine-2-carbothioamide
CID 64589638
2-[4-[(4-tert-butyl-1,3-thiazol-2-yl)amino]phenyl]acetamide
CID 90824816
6-acetamidopyrazine-2-carboxamide
CID 119095151
2-[(4-tert-butyl-1,3-thiazol-2-yl)amino]-5-chloropyridine-4-carboxylic acid
CID 114919380
2-N-(4-tert-butyl-1,3-thiazol-2-yl)-6-methylpyridine-2,5-diamine
CID 114049823
methyl 5-amino-6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyridine-2-carboxylate
CID 114405863
(2R)-2-amino-N-(4-tert-butyl-1,3-thiazol-2-yl)propanamide
CID 78973521
5-amino-N-(4-tert-butyl-1,3-thiazol-2-yl)pyridine-2-carboxamide
CID 81316674
N-(4-tert-butyl-1,3-thiazol-2-yl)-5-carbamothioylpyridine-2-carboxamide
CID 63749555
6-[2-(dimethylamino)ethylamino]pyrazine-2-carboxamide
CID 133447093
(4-tert-butyl-1,3-thiazol-2-yl)cyanamide
CID 27060536
5-[(4-tert-butyl-1,3-thiazol-2-yl)amino]furan-2-carboxylic acid
CID 62206727

Frequently Asked Questions

What is the IUPAC name of 6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide?
The IUPAC name of 6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide (CID 170511217) is 6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide.
What is the SMILES notation for 6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide?
The canonical SMILES for 6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide is CC(C)(C)c1csc(Nc2cncc(C(N)=O)n2)n1.
What is the InChIKey of 6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide?
The InChIKey is WVAHQCPBZYLNSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5OS/c1-12(2,3)8-6-19-11(16-8)17-9-5-14-4-7(15-9)10(13)18/h4-6H,1-3H3,(H2,13,18)(H,15,16,17).
What are the key properties of 6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide?
6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide has a molecular weight of 277.35 g/mol, XLogP of 2.07, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-tert-butyl-1,3-thiazol-2-yl)amino]pyrazine-2-carboxamide is sourced from PubChem (CID 170511217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).