N-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide

C9H15N3O2 — CID 43420533

IUPACN-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESCC(C)N(C)C(=O)C1=NNC(=O)CC1
InChIInChI=1S/C9H15N3O2/c1-6(2)12(3)9(14)7-4-5-8(13)11-10-7/h6H,4-5H2,1-3H3,(H,11,13)
InChIKeyVYLLQCWAEAAUEW-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.12
Rot. Bonds2

About N-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide

N-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide (PubChem CID 43420533) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is N-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide
PubChem CID43420533
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC NameN-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESCC(C)N(C)C(=O)C1=NNC(=O)CC1
InChIInChI=1S/C9H15N3O2/c1-6(2)12(3)9(14)7-4-5-8(13)11-10-7/h6H,4-5H2,1-3H3,(H,11,13)
InChIKeyVYLLQCWAEAAUEW-UHFFFAOYSA-N
XLogP0.12
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
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-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide?
The IUPAC name of N-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide (CID 43420533) is N-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide.
What is the SMILES notation for N-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide?
The canonical SMILES for N-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide is CC(C)N(C)C(=O)C1=NNC(=O)CC1.
What is the InChIKey of N-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide?
The InChIKey is VYLLQCWAEAAUEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-6(2)12(3)9(14)7-4-5-8(13)11-10-7/h6H,4-5H2,1-3H3,(H,11,13).
What are the key properties of N-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide?
N-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide has a molecular weight of 197.24 g/mol, XLogP of 0.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-oxo-N-propan-2-yl-4,5-dihydro-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 43420533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).