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

C11H13N5OS — CID 114035836

IUPAC6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide
SMILESCNc1cncc(C(=O)NCc2csc(C)n2)n1
InChIInChI=1S/C11H13N5OS/c1-7-15-8(6-18-7)3-14-11(17)9-4-13-5-10(12-2)16-9/h4-6H,3H2,1-2H3,(H,12,16)(H,14,17)
InChIKeyWJNLVAQFDDIVIT-UHFFFAOYSA-N
MW263.33 g/mol
LogP1.21
Rot. Bonds4

About 6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide

6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide (PubChem CID 114035836) has the molecular formula C11H13N5OS and a molecular weight of 263.33 g/mol. Its IUPAC name is 6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide
PubChem CID114035836
Molecular FormulaC11H13N5OS
Molecular Weight263.33 g/mol
Exact Mass263.08
IUPAC Name6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide
SMILESCNc1cncc(C(=O)NCc2csc(C)n2)n1
InChIInChI=1S/C11H13N5OS/c1-7-15-8(6-18-7)3-14-11(17)9-4-13-5-10(12-2)16-9/h4-6H,3H2,1-2H3,(H,12,16)(H,14,17)
InChIKeyWJNLVAQFDDIVIT-UHFFFAOYSA-N
XLogP1.21
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.33
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridazine-3-carboxamide
CID 62174780
6-hydrazinyl-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazine-2-carboxamide
CID 106040179
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-6-(methylamino)pyrazine-2-carboxamide
CID 106377315
6-(methylamino)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]pyrazine-2-carboxamide
CID 114035852
5-bromo-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridine-3-carboxamide
CID 47044611
N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridine-3-carboxamide
CID 47290675
N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-(methylamino)pyrazine-2-carboxamide
CID 106304126
3-methyl-4-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]benzamide
CID 55163251
N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-2-methyl-1,3-thiazole-4-carboxamide
CID 50970588
5-(3-hydroxyprop-1-ynyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridine-2-carboxamide
CID 62958804
4-hydrazinyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridine-2-carboxamide
CID 62249646
2-bromo-N-[(2-methyl-1,3-thiazol-4-yl)methyl]acetamide
CID 63680112

Frequently Asked Questions

What is the IUPAC name of 6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide?
The IUPAC name of 6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide (CID 114035836) is 6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide.
What is the SMILES notation for 6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide?
The canonical SMILES for 6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide is CNc1cncc(C(=O)NCc2csc(C)n2)n1.
What is the InChIKey of 6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide?
The InChIKey is WJNLVAQFDDIVIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5OS/c1-7-15-8(6-18-7)3-14-11(17)9-4-13-5-10(12-2)16-9/h4-6H,3H2,1-2H3,(H,12,16)(H,14,17).
What are the key properties of 6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide?
6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide has a molecular weight of 263.33 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazine-2-carboxamide is sourced from PubChem (CID 114035836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).