3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol

C11H16ClN3O — CID 62468492

IUPAC3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol
SMILESOCCCC1CCCN1c1ccc(Cl)nn1
InChIInChI=1S/C11H16ClN3O/c12-10-5-6-11(14-13-10)15-7-1-3-9(15)4-2-8-16/h5-6,9,16H,1-4,7-8H2
InChIKeyRASFNAAJWMHERF-UHFFFAOYSA-N
MW241.72 g/mol
LogP1.87
Rot. Bonds4

About 3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol

3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol (PubChem CID 62468492) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is 3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol.

Molecular Properties

Compound Name3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol
PubChem CID62468492
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC Name3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol
SMILESOCCCC1CCCN1c1ccc(Cl)nn1
InChIInChI=1S/C11H16ClN3O/c12-10-5-6-11(14-13-10)15-7-1-3-9(15)4-2-8-16/h5-6,9,16H,1-4,7-8H2
InChIKeyRASFNAAJWMHERF-UHFFFAOYSA-N
XLogP1.87
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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3-[1-(6-chloro-2-propan-2-ylpyrimidin-4-yl)pyrrolidin-2-yl]propan-1-ol
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3-[1-[6-chloro-2-(methoxymethyl)pyrimidin-4-yl]pyrrolidin-2-yl]propan-1-ol
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2-[1-(6-chloropyridazin-3-yl)pyrrolidin-3-yl]ethanol
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Frequently Asked Questions

What is the IUPAC name of 3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol?
The IUPAC name of 3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol (CID 62468492) is 3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol.
What is the SMILES notation for 3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol?
The canonical SMILES for 3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol is OCCCC1CCCN1c1ccc(Cl)nn1.
What is the InChIKey of 3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol?
The InChIKey is RASFNAAJWMHERF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O/c12-10-5-6-11(14-13-10)15-7-1-3-9(15)4-2-8-16/h5-6,9,16H,1-4,7-8H2.
What are the key properties of 3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol?
3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol has a molecular weight of 241.72 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(6-chloropyridazin-3-yl)pyrrolidin-2-yl]propan-1-ol is sourced from PubChem (CID 62468492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).