1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol

C14H14ClN3O — CID 3022107

IUPAC1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol
SMILESOC1CCN(c2ccc(-c3ccccc3Cl)nn2)C1
InChIInChI=1S/C14H14ClN3O/c15-12-4-2-1-3-11(12)13-5-6-14(17-16-13)18-8-7-10(19)9-18/h1-6,10,19H,7-9H2
InChIKeyMZOCABWMUGOCBO-UHFFFAOYSA-N
MW275.74 g/mol
LogP2.37
Rot. Bonds2

About 1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol

1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol (PubChem CID 3022107) has the molecular formula C14H14ClN3O and a molecular weight of 275.74 g/mol. Its IUPAC name is 1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol.

Molecular Properties

Compound Name1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol
PubChem CID3022107
Molecular FormulaC14H14ClN3O
Molecular Weight275.74 g/mol
Exact Mass275.08
IUPAC Name1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol
SMILESOC1CCN(c2ccc(-c3ccccc3Cl)nn2)C1
InChIInChI=1S/C14H14ClN3O/c15-12-4-2-1-3-11(12)13-5-6-14(17-16-13)18-8-7-10(19)9-18/h1-6,10,19H,7-9H2
InChIKeyMZOCABWMUGOCBO-UHFFFAOYSA-N
XLogP2.37
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidine-4-carboxylic acid
CID 56770692
(3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine
CID 95361082
2-[1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-4-yl]acetamide
CID 136568304
1-[6-(2-bromophenyl)pyridazin-3-yl]piperidin-3-ol
CID 116972807
1-[6-(1H-pyrrol-2-yl)pyridazin-3-yl]pyrrolidin-3-ol
CID 116972898
1-[6-(4-fluorophenyl)pyridazin-3-yl]pyrrolidin-3-ol
CID 56770273
1-[6-(3-methylphenyl)pyridazin-3-yl]pyrrolidin-3-ol
CID 56770780
1-(6-phenylpyridazin-3-yl)piperidin-4-ol
CID 3022103
3,4-dichloro-N-[1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-yl]benzamide
CID 175425958
N-[2-[4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl]-2-oxoethyl]-N-cyclopropylcyclopropanecarboxamide
CID 46001868
1-[5-chloro-6-(hydroxymethyl)-2-pyridinyl]pyrrolidin-3-ol
CID 62943778
1-[6-(4-ethylphenyl)pyridazin-3-yl]piperidin-3-ol
CID 56770757

Frequently Asked Questions

What is the IUPAC name of 1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol?
The IUPAC name of 1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol (CID 3022107) is 1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol.
What is the SMILES notation for 1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol?
The canonical SMILES for 1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol is OC1CCN(c2ccc(-c3ccccc3Cl)nn2)C1.
What is the InChIKey of 1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol?
The InChIKey is MZOCABWMUGOCBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O/c15-12-4-2-1-3-11(12)13-5-6-14(17-16-13)18-8-7-10(19)9-18/h1-6,10,19H,7-9H2.
What are the key properties of 1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol?
1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol has a molecular weight of 275.74 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol is sourced from PubChem (CID 3022107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).