6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide

C12H18N4O3 — CID 60651329

IUPAC6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESO=C1CCC(C(=O)NCCC(=O)N2CCCC2)=NN1
InChIInChI=1S/C12H18N4O3/c17-10-4-3-9(14-15-10)12(19)13-6-5-11(18)16-7-1-2-8-16/h1-8H2,(H,13,19)(H,15,17)
InChIKeyVKBVSSLZUSTEGP-UHFFFAOYSA-N
MW266.30 g/mol
LogP-0.62
Rot. Bonds4

About 6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide

6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide (PubChem CID 60651329) has the molecular formula C12H18N4O3 and a molecular weight of 266.30 g/mol. Its IUPAC name is 6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide
PubChem CID60651329
Molecular FormulaC12H18N4O3
Molecular Weight266.30 g/mol
Exact Mass266.14
IUPAC Name6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESO=C1CCC(C(=O)NCCC(=O)N2CCCC2)=NN1
InChIInChI=1S/C12H18N4O3/c17-10-4-3-9(14-15-10)12(19)13-6-5-11(18)16-7-1-2-8-16/h1-8H2,(H,13,19)(H,15,17)
InChIKeyVKBVSSLZUSTEGP-UHFFFAOYSA-N
XLogP-0.62
TPSA90.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 5-0.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(pyrrolidine-1-carbonyl)-4,5-dihydro-1H-pyridazin-6-one
CID 43397830
3-(4-butanoyl-1,4-diazepane-1-carbonyl)-4,5-dihydro-1H-pyridazin-6-one
CID 110805956
N-[2-(3-hydroxypropylsulfanyl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 103801118
N-(3-oxo-3-piperidin-1-ylpropyl)-2H-tetrazole-5-carboxamide
CID 113411631
6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)piperidine-3-carboxamide
CID 112728746
N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrrolidine-1-carboxamide
CID 113221674
N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 110742789
4-fluoro-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide
CID 47250876
3,6-dichloro-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyridine-2-carboxamide
CID 46597760
4-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-3H-phthalazine-1-carboxamide
CID 46598237
N-(3-oxo-3-piperidin-1-ylpropyl)benzamide
CID 17154515
6-chloro-N-(3-oxo-3-piperidin-1-ylpropyl)pyrazine-2-carboxamide
CID 103187315

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide?
The IUPAC name of 6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide (CID 60651329) is 6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide?
The canonical SMILES for 6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide is O=C1CCC(C(=O)NCCC(=O)N2CCCC2)=NN1.
What is the InChIKey of 6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide?
The InChIKey is VKBVSSLZUSTEGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O3/c17-10-4-3-9(14-15-10)12(19)13-6-5-11(18)16-7-1-2-8-16/h1-8H2,(H,13,19)(H,15,17).
What are the key properties of 6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide?
6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide has a molecular weight of 266.30 g/mol, XLogP of -0.62, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4,5-dihydro-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 60651329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).