5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide

C12H13N5O — CID 107586715

IUPAC5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)Nc2cncc(C)c2)cn1
InChIInChI=1S/C12H13N5O/c1-8-3-9(5-14-4-8)17-12(18)10-6-16-11(13-2)7-15-10/h3-7H,1-2H3,(H,13,16)(H,17,18)
InChIKeyXGXIWAFYQRMMLN-UHFFFAOYSA-N
MW243.27 g/mol
LogP1.47
Rot. Bonds3

About 5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide

5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide (PubChem CID 107586715) has the molecular formula C12H13N5O and a molecular weight of 243.27 g/mol. Its IUPAC name is 5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide
PubChem CID107586715
Molecular FormulaC12H13N5O
Molecular Weight243.27 g/mol
Exact Mass243.11
IUPAC Name5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)Nc2cncc(C)c2)cn1
InChIInChI=1S/C12H13N5O/c1-8-3-9(5-14-4-8)17-12(18)10-6-16-11(13-2)7-15-10/h3-7H,1-2H3,(H,13,16)(H,17,18)
InChIKeyXGXIWAFYQRMMLN-UHFFFAOYSA-N
XLogP1.47
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide (CID 107586715) is 5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide is CNc1cnc(C(=O)Nc2cncc(C)c2)cn1.
What is the InChIKey of 5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide?
The InChIKey is XGXIWAFYQRMMLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N5O/c1-8-3-9(5-14-4-8)17-12(18)10-6-16-11(13-2)7-15-10/h3-7H,1-2H3,(H,13,16)(H,17,18).
What are the key properties of 5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide?
5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide has a molecular weight of 243.27 g/mol, XLogP of 1.47, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylamino)-N-(5-methyl-3-pyridinyl)pyrazine-2-carboxamide is sourced from PubChem (CID 107586715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).