N-methyl-6-oxopyridazine-1-carboxamide

C6H7N3O2 — CID 141012448

IUPACN-methyl-6-oxopyridazine-1-carboxamide
SMILESCNC(=O)n1ncccc1=O
InChIInChI=1S/C6H7N3O2/c1-7-6(11)9-5(10)3-2-4-8-9/h2-4H,1H3,(H,7,11)
InChIKeyAFEKPRSKCFRWOX-UHFFFAOYSA-N
MW153.14 g/mol
LogP-0.57
Rot. Bonds

About N-methyl-6-oxopyridazine-1-carboxamide

N-methyl-6-oxopyridazine-1-carboxamide (PubChem CID 141012448) has the molecular formula C6H7N3O2 and a molecular weight of 153.14 g/mol. Its IUPAC name is N-methyl-6-oxopyridazine-1-carboxamide.

Molecular Properties

Compound NameN-methyl-6-oxopyridazine-1-carboxamide
PubChem CID141012448
Molecular FormulaC6H7N3O2
Molecular Weight153.14 g/mol
Exact Mass153.05
IUPAC NameN-methyl-6-oxopyridazine-1-carboxamide
SMILESCNC(=O)n1ncccc1=O
InChIInChI=1S/C6H7N3O2/c1-7-6(11)9-5(10)3-2-4-8-9/h2-4H,1H3,(H,7,11)
InChIKeyAFEKPRSKCFRWOX-UHFFFAOYSA-N
XLogP-0.57
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.14
LogP ≤ 5-0.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-oxopyridazine-1-carboxamide?
The IUPAC name of N-methyl-6-oxopyridazine-1-carboxamide (CID 141012448) is N-methyl-6-oxopyridazine-1-carboxamide.
What is the SMILES notation for N-methyl-6-oxopyridazine-1-carboxamide?
The canonical SMILES for N-methyl-6-oxopyridazine-1-carboxamide is CNC(=O)n1ncccc1=O.
What is the InChIKey of N-methyl-6-oxopyridazine-1-carboxamide?
The InChIKey is AFEKPRSKCFRWOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O2/c1-7-6(11)9-5(10)3-2-4-8-9/h2-4H,1H3,(H,7,11).
What are the key properties of N-methyl-6-oxopyridazine-1-carboxamide?
N-methyl-6-oxopyridazine-1-carboxamide has a molecular weight of 153.14 g/mol, XLogP of -0.57, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-oxopyridazine-1-carboxamide is sourced from PubChem (CID 141012448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).