3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one

C9H11N3O3 — CID 62917112

IUPAC3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one
SMILESO=C(c1ccc(=O)[nH]n1)N1CCC(O)C1
InChIInChI=1S/C9H11N3O3/c13-6-3-4-12(5-6)9(15)7-1-2-8(14)11-10-7/h1-2,6,13H,3-5H2,(H,11,14)
InChIKeyUHMSLADCXNLSTG-UHFFFAOYSA-N
MW209.20 g/mol
LogP-1.02
Rot. Bonds1

About 3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one

3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one (PubChem CID 62917112) has the molecular formula C9H11N3O3 and a molecular weight of 209.20 g/mol. Its IUPAC name is 3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one.

Molecular Properties

Compound Name3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one
PubChem CID62917112
Molecular FormulaC9H11N3O3
Molecular Weight209.20 g/mol
Exact Mass209.08
IUPAC Name3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one
SMILESO=C(c1ccc(=O)[nH]n1)N1CCC(O)C1
InChIInChI=1S/C9H11N3O3/c13-6-3-4-12(5-6)9(15)7-1-2-8(14)11-10-7/h1-2,6,13H,3-5H2,(H,11,14)
InChIKeyUHMSLADCXNLSTG-UHFFFAOYSA-N
XLogP-1.02
TPSA86.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 5-1.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxyethyl)-6-oxo-N-(2,2,2-trifluoroethyl)-1H-pyridazine-3-carboxamide
CID 113339822
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 113964769
N-(2-hydroxypropyl)-1-methyl-6-oxopyridazine-3-carboxamide
CID 43391159
6-(4-Hydroxypiperidine-1-carbonyl)-2,3-dihydropyridazin-3-one
CID 43391780
6-(3-Hydroxypiperidine-1-carbonyl)-2,3-dihydropyridazin-3-one
CID 43415713
N-(3-hydroxypropyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 43417825
1-butyl-N-(2-hydroxypropyl)-6-oxopyridazine-3-carboxamide
CID 43418478
N-(2-hydroxypropyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 43418502
N-(1-hydroxypropan-2-yl)-6-oxo-1H-pyridazine-3-carboxamide
CID 43419079
N-(2-hydroxyethyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide
CID 43573621
N-cyclopropyl-N-(2-hydroxyethyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 43577212
N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide
CID 54916808

Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one?
The IUPAC name of 3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one (CID 62917112) is 3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one.
What is the SMILES notation for 3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one?
The canonical SMILES for 3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one is O=C(c1ccc(=O)[nH]n1)N1CCC(O)C1.
What is the InChIKey of 3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one?
The InChIKey is UHMSLADCXNLSTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O3/c13-6-3-4-12(5-6)9(15)7-1-2-8(14)11-10-7/h1-2,6,13H,3-5H2,(H,11,14).
What are the key properties of 3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one?
3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one has a molecular weight of 209.20 g/mol, XLogP of -1.02, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxypyrrolidine-1-carbonyl)-1H-pyridazin-6-one is sourced from PubChem (CID 62917112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).