5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide

C11H14N6O — CID 107375122

IUPAC5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)NCc2cnn(C)c2)cn1
InChIInChI=1S/C11H14N6O/c1-12-10-6-13-9(5-14-10)11(18)15-3-8-4-16-17(2)7-8/h4-7H,3H2,1-2H3,(H,12,14)(H,15,18)
InChIKeyKAUJRJLWPXKSLA-UHFFFAOYSA-N
MW246.27 g/mol
LogP0.18
Rot. Bonds4

About 5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide

5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide (PubChem CID 107375122) has the molecular formula C11H14N6O and a molecular weight of 246.27 g/mol. Its IUPAC name is 5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide
PubChem CID107375122
Molecular FormulaC11H14N6O
Molecular Weight246.27 g/mol
Exact Mass246.12
IUPAC Name5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)NCc2cnn(C)c2)cn1
InChIInChI=1S/C11H14N6O/c1-12-10-6-13-9(5-14-10)11(18)15-3-8-4-16-17(2)7-8/h4-7H,3H2,1-2H3,(H,12,14)(H,15,18)
InChIKeyKAUJRJLWPXKSLA-UHFFFAOYSA-N
XLogP0.18
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(methylamino)-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2-carboxamide
CID 107375550
N-[2-(1-methylpyrazol-4-yl)ethyl]-5-(propylamino)pyrazine-2-carboxamide
CID 107376316
1-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazole-4-carboxamide
CID 19474553
6-chloro-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide
CID 103187169
6-hydrazinyl-N-[(1-methylpyrazol-4-yl)methyl]pyridazine-3-carboxamide
CID 62248075
5-(3-hydroxyprop-1-ynyl)-N-[(1-methylpyrazol-4-yl)methyl]pyridine-2-carboxamide
CID 62959360
N-(2,2-dicyclopropylethyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107375993
N-(2-acetamidoethyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107374531
N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide
CID 35523459
4-amino-1-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrole-2-carboxamide
CID 61348466
5-bromo-N-[(1-methylpyrazol-4-yl)methyl]furan-2-carboxamide
CID 39891817
1-cyclohexyl-3-[(1-methylpyrazol-4-yl)methyl]urea
CID 2932925

Frequently Asked Questions

What is the IUPAC name of 5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide?
The IUPAC name of 5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide (CID 107375122) is 5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide?
The canonical SMILES for 5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide is CNc1cnc(C(=O)NCc2cnn(C)c2)cn1.
What is the InChIKey of 5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide?
The InChIKey is KAUJRJLWPXKSLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O/c1-12-10-6-13-9(5-14-10)11(18)15-3-8-4-16-17(2)7-8/h4-7H,3H2,1-2H3,(H,12,14)(H,15,18).
What are the key properties of 5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide?
5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 0.18, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide is sourced from PubChem (CID 107375122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).