N,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide

C9H15N3O2 — CID 43397845

IUPACN,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESCCN(CC)C(=O)C1=NNC(=O)CC1
InChIInChI=1S/C9H15N3O2/c1-3-12(4-2)9(14)7-5-6-8(13)11-10-7/h3-6H2,1-2H3,(H,11,13)
InChIKeyJQZCUEKOVNZXAQ-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.12
Rot. Bonds3

About N,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide

N,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide (PubChem CID 43397845) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is N,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
PubChem CID43397845
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC NameN,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESCCN(CC)C(=O)C1=NNC(=O)CC1
InChIInChI=1S/C9H15N3O2/c1-3-12(4-2)9(14)7-5-6-8(13)11-10-7/h3-6H2,1-2H3,(H,11,13)
InChIKeyJQZCUEKOVNZXAQ-UHFFFAOYSA-N
XLogP0.12
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide?
The IUPAC name of N,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide (CID 43397845) is N,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide.
What is the SMILES notation for N,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide?
The canonical SMILES for N,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide is CCN(CC)C(=O)C1=NNC(=O)CC1.
What is the InChIKey of N,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide?
The InChIKey is JQZCUEKOVNZXAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-3-12(4-2)9(14)7-5-6-8(13)11-10-7/h3-6H2,1-2H3,(H,11,13).
What are the key properties of N,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide?
N,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide has a molecular weight of 197.24 g/mol, XLogP of 0.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 43397845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).