1-pyridazin-4-ylpyrrolidin-3-ol

C8H11N3O — CID 112757115

IUPAC1-pyridazin-4-ylpyrrolidin-3-ol
SMILESOC1CCN(c2ccnnc2)C1
InChIInChI=1S/C8H11N3O/c12-8-2-4-11(6-8)7-1-3-9-10-5-7/h1,3,5,8,12H,2,4,6H2
InChIKeyDVMYRQWBMSHRLM-UHFFFAOYSA-N
MW165.20 g/mol
LogP0.05
Rot. Bonds1

About 1-pyridazin-4-ylpyrrolidin-3-ol

1-pyridazin-4-ylpyrrolidin-3-ol (PubChem CID 112757115) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is 1-pyridazin-4-ylpyrrolidin-3-ol.

Molecular Properties

Compound Name1-pyridazin-4-ylpyrrolidin-3-ol
PubChem CID112757115
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC Name1-pyridazin-4-ylpyrrolidin-3-ol
SMILESOC1CCN(c2ccnnc2)C1
InChIInChI=1S/C8H11N3O/c12-8-2-4-11(6-8)7-1-3-9-10-5-7/h1,3,5,8,12H,2,4,6H2
InChIKeyDVMYRQWBMSHRLM-UHFFFAOYSA-N
XLogP0.05
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-Pyrrolidin-1-ylpyridazine
CID 12449299
4-(4-Pyridazinyl)morpholine
CID 6401376
2-(N-methyl-N-(pyridazin-4-yl)amino)ethanol
CID 22030726
(3R,4R)-4-methyl-1-pyridazin-4-ylpyrrolidin-3-ol
CID 54333694
2-(Pyridazin-4-ylamino)ethanol
CID 56983374
CID 87167876
CID 87167876
3-Chloro-5-(3-methoxypyrrolidin-1-yl)pyridazine
CID 103542310
1-[Methyl-[(2-methylpyrazol-3-yl)methyl]amino]-3-(4-methylpiperazin-1-yl)propan-2-ol
CID 109984202
1-Pyridazin-4-ylpiperidin-3-ol
CID 112757114
1-Pyridazin-4-ylpiperidin-4-ol
CID 112757116
(3R)-1-pyridazin-4-ylpiperidin-3-ol
CID 124676119
(3S)-1-pyridazin-4-ylpiperidin-3-ol
CID 124676120

Frequently Asked Questions

What is the IUPAC name of 1-pyridazin-4-ylpyrrolidin-3-ol?
The IUPAC name of 1-pyridazin-4-ylpyrrolidin-3-ol (CID 112757115) is 1-pyridazin-4-ylpyrrolidin-3-ol.
What is the SMILES notation for 1-pyridazin-4-ylpyrrolidin-3-ol?
The canonical SMILES for 1-pyridazin-4-ylpyrrolidin-3-ol is OC1CCN(c2ccnnc2)C1.
What is the InChIKey of 1-pyridazin-4-ylpyrrolidin-3-ol?
The InChIKey is DVMYRQWBMSHRLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c12-8-2-4-11(6-8)7-1-3-9-10-5-7/h1,3,5,8,12H,2,4,6H2.
What are the key properties of 1-pyridazin-4-ylpyrrolidin-3-ol?
1-pyridazin-4-ylpyrrolidin-3-ol has a molecular weight of 165.20 g/mol, XLogP of 0.05, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridazin-4-ylpyrrolidin-3-ol is sourced from PubChem (CID 112757115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).