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

C11H13N5OS — CID 122569497

IUPAC6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide
SMILESCc1csc(CCNc2cncc(C(N)=O)n2)n1
InChIInChI=1S/C11H13N5OS/c1-7-6-18-10(15-7)2-3-14-9-5-13-4-8(16-9)11(12)17/h4-6H,2-3H2,1H3,(H2,12,17)(H,14,16)
InChIKeyNLNCZEBNNMWMCH-UHFFFAOYSA-N
MW263.33 g/mol
LogP1.00
Rot. Bonds5

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

6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide (PubChem CID 122569497) has the molecular formula C11H13N5OS and a molecular weight of 263.33 g/mol. Its IUPAC name is 6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide
PubChem CID122569497
Molecular FormulaC11H13N5OS
Molecular Weight263.33 g/mol
Exact Mass263.08
IUPAC Name6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide
SMILESCc1csc(CCNc2cncc(C(N)=O)n2)n1
InChIInChI=1S/C11H13N5OS/c1-7-6-18-10(15-7)2-3-14-9-5-13-4-8(16-9)11(12)17/h4-6H,2-3H2,1H3,(H2,12,17)(H,14,16)
InChIKeyNLNCZEBNNMWMCH-UHFFFAOYSA-N
XLogP1.00
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.33
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide?
The IUPAC name of 6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide (CID 122569497) is 6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide.
What is the SMILES notation for 6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide?
The canonical SMILES for 6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide is Cc1csc(CCNc2cncc(C(N)=O)n2)n1.
What is the InChIKey of 6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide?
The InChIKey is NLNCZEBNNMWMCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5OS/c1-7-6-18-10(15-7)2-3-14-9-5-13-4-8(16-9)11(12)17/h4-6H,2-3H2,1H3,(H2,12,17)(H,14,16).
What are the key properties of 6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide?
6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide has a molecular weight of 263.33 g/mol, XLogP of 1.00, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxamide is sourced from PubChem (CID 122569497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).