5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide

C15H19N5OS — CID 110257613

IUPAC5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide
SMILESCc1csc(NC(=O)c2cnc(C3CCCN(C)C3)cn2)n1
InChIInChI=1S/C15H19N5OS/c1-10-9-22-15(18-10)19-14(21)13-7-16-12(6-17-13)11-4-3-5-20(2)8-11/h6-7,9,11H,3-5,8H2,1-2H3,(H,18,19,21)
InChIKeyGLXDKTUSSBTAGA-UHFFFAOYSA-N
MW317.42 g/mol
LogP2.30
Rot. Bonds3

About 5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide

5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide (PubChem CID 110257613) has the molecular formula C15H19N5OS and a molecular weight of 317.42 g/mol. Its IUPAC name is 5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide
PubChem CID110257613
Molecular FormulaC15H19N5OS
Molecular Weight317.42 g/mol
Exact Mass317.13
IUPAC Name5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide
SMILESCc1csc(NC(=O)c2cnc(C3CCCN(C)C3)cn2)n1
InChIInChI=1S/C15H19N5OS/c1-10-9-22-15(18-10)19-14(21)13-7-16-12(6-17-13)11-4-3-5-20(2)8-11/h6-7,9,11H,3-5,8H2,1-2H3,(H,18,19,21)
InChIKeyGLXDKTUSSBTAGA-UHFFFAOYSA-N
XLogP2.30
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.42
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide?
The IUPAC name of 5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide (CID 110257613) is 5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide is Cc1csc(NC(=O)c2cnc(C3CCCN(C)C3)cn2)n1.
What is the InChIKey of 5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide?
The InChIKey is GLXDKTUSSBTAGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5OS/c1-10-9-22-15(18-10)19-14(21)13-7-16-12(6-17-13)11-4-3-5-20(2)8-11/h6-7,9,11H,3-5,8H2,1-2H3,(H,18,19,21).
What are the key properties of 5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide?
5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide has a molecular weight of 317.42 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylpiperidin-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 110257613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).