5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide

C11H12N6O — CID 107377345

IUPAC5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)NCc2cccnn2)cn1
InChIInChI=1S/C11H12N6O/c1-12-10-7-13-9(6-14-10)11(18)15-5-8-3-2-4-16-17-8/h2-4,6-7H,5H2,1H3,(H,12,14)(H,15,18)
InChIKeyCQLGLXGBDQPGDG-UHFFFAOYSA-N
MW244.26 g/mol
LogP0.24
Rot. Bonds4

About 5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide

5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide (PubChem CID 107377345) has the molecular formula C11H12N6O and a molecular weight of 244.26 g/mol. Its IUPAC name is 5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide
PubChem CID107377345
Molecular FormulaC11H12N6O
Molecular Weight244.26 g/mol
Exact Mass244.11
IUPAC Name5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)NCc2cccnn2)cn1
InChIInChI=1S/C11H12N6O/c1-12-10-7-13-9(6-14-10)11(18)15-5-8-3-2-4-16-17-8/h2-4,6-7H,5H2,1H3,(H,12,14)(H,15,18)
InChIKeyCQLGLXGBDQPGDG-UHFFFAOYSA-N
XLogP0.24
TPSA92.69 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.26
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-(methylamino)-N-(pyridazin-3-ylmethyl)pyridine-2-carboxamide
CID 106897654
5-(methylamino)-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2-carboxamide
CID 107375550
4-(methylamino)-N-(pyridazin-3-ylmethyl)pyridine-3-carboxamide
CID 106897669
N-(pyridin-2-ylmethyl)-5-(pyridin-2-ylmethylamino)pyrazine-2-carboxamide
CID 109282922
6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide
CID 106897771
6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridine-2-carboxamide
CID 106897774
6-bromo-N-(pyridazin-3-ylmethyl)pyridine-2-carboxamide
CID 106832234
N-[(4,5-dimethylthiophen-2-yl)methyl]-5-(methylamino)pyrazine-2-carboxamide
CID 107375938
N-(2-acetamidoethyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107374531
3-amino-N-(pyridazin-3-ylmethyl)pyridine-2-carboxamide
CID 106896014
6-chloro-N-(pyridazin-3-ylmethyl)pyridine-3-carboxamide
CID 106832257
5-(methylamino)-N-[(1-methylpyrazol-4-yl)methyl]pyrazine-2-carboxamide
CID 107375122

Frequently Asked Questions

What is the IUPAC name of 5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide (CID 107377345) is 5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide is CNc1cnc(C(=O)NCc2cccnn2)cn1.
What is the InChIKey of 5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide?
The InChIKey is CQLGLXGBDQPGDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N6O/c1-12-10-7-13-9(6-14-10)11(18)15-5-8-3-2-4-16-17-8/h2-4,6-7H,5H2,1H3,(H,12,14)(H,15,18).
What are the key properties of 5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide?
5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide has a molecular weight of 244.26 g/mol, XLogP of 0.24, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylamino)-N-(pyridazin-3-ylmethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 107377345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).