1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone

C10H13N3O2 — CID 90638196

IUPAC1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone
SMILESCC(=O)N1CCC(Oc2cccnn2)C1
InChIInChI=1S/C10H13N3O2/c1-8(14)13-6-4-9(7-13)15-10-3-2-5-11-12-10/h2-3,5,9H,4,6-7H2,1H3
InChIKeyDVZFNCVJRDMARE-UHFFFAOYSA-N
MW207.23 g/mol
LogP0.48
Rot. Bonds2

About 1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone

1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone (PubChem CID 90638196) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone.

Molecular Properties

Compound Name1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone
PubChem CID90638196
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone
SMILESCC(=O)N1CCC(Oc2cccnn2)C1
InChIInChI=1S/C10H13N3O2/c1-8(14)13-6-4-9(7-13)15-10-3-2-5-11-12-10/h2-3,5,9H,4,6-7H2,1H3
InChIKeyDVZFNCVJRDMARE-UHFFFAOYSA-N
XLogP0.48
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[(3R)-3-pyridazin-3-yloxypiperidine-1-carbonyl]piperidin-1-yl]ethanone
CID 100638372
tert-butyl (3R)-3-pyridazin-3-yloxypyrrolidine-1-carboxylate
CID 129411647
(4-methylpiperazin-1-yl)-[(3R)-3-pyridazin-3-yloxypyrrolidin-1-yl]methanone
CID 100624368
N-propan-2-yl-3-pyridazin-3-yloxypyrrolidine-1-carboxamide
CID 90638477
2,2,2-trifluoro-1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone
CID 159511918
N-cycloheptyl-3-pyridazin-3-yloxypyrrolidine-1-carboxamide
CID 90638486
(2R)-2-hydroxy-2-phenyl-1-[(3S)-3-pyridazin-3-yloxypyrrolidin-1-yl]ethanone
CID 100622951
(5-methylpyrazin-2-yl)-[(3R)-3-pyridazin-3-yloxypyrrolidin-1-yl]methanone
CID 100623677
N-(2-methoxyethyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide
CID 91627281
(5-methylpyrazin-2-yl)-(3-pyridazin-3-yloxypyrrolidin-1-yl)methanone
CID 91627264
4-chloro-1-(3-pyridazin-3-yloxypyrrolidin-1-yl)butan-1-one
CID 90638218
(4-phenylphenyl)-(3-pyridazin-3-yloxypyrrolidin-1-yl)methanone
CID 90638273

Frequently Asked Questions

What is the IUPAC name of 1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone?
The IUPAC name of 1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone (CID 90638196) is 1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone.
What is the SMILES notation for 1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone?
The canonical SMILES for 1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone is CC(=O)N1CCC(Oc2cccnn2)C1.
What is the InChIKey of 1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone?
The InChIKey is DVZFNCVJRDMARE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c1-8(14)13-6-4-9(7-13)15-10-3-2-5-11-12-10/h2-3,5,9H,4,6-7H2,1H3.
What are the key properties of 1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone?
1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone has a molecular weight of 207.23 g/mol, XLogP of 0.48, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone is sourced from PubChem (CID 90638196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).