1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol

C14H22N4O — CID 116972763

IUPAC1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol
SMILESCN1CCC(c2ccc(N3CCC(O)CC3)nn2)C1
InChIInChI=1S/C14H22N4O/c1-17-7-4-11(10-17)13-2-3-14(16-15-13)18-8-5-12(19)6-9-18/h2-3,11-12,19H,4-10H2,1H3
InChIKeyOZDHAMPNWCAWFA-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.86
Rot. Bonds2

About 1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol

1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol (PubChem CID 116972763) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol.

Molecular Properties

Compound Name1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol
PubChem CID116972763
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol
SMILESCN1CCC(c2ccc(N3CCC(O)CC3)nn2)C1
InChIInChI=1S/C14H22N4O/c1-17-7-4-11(10-17)13-2-3-14(16-15-13)18-8-5-12(19)6-9-18/h2-3,11-12,19H,4-10H2,1H3
InChIKeyOZDHAMPNWCAWFA-UHFFFAOYSA-N
XLogP0.86
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-3-ol
CID 116972808
1-[6-(oxan-4-yl)pyridazin-3-yl]pyrrolidin-3-ol
CID 116972911
[1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]pyrrolidin-2-yl]methanamine
CID 116973044
1-(6-cyclopropylpyridazin-3-yl)pyrrolidin-3-amine
CID 83832620
1-[methyl-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]amino]propan-2-one
CID 116974030
1-(6-phenylpyridazin-3-yl)piperidin-4-ol
CID 3022103
3-(1-methylpyrrolidin-3-yl)pyridazine
CID 117105038
1-(6-propylpyridazin-3-yl)piperidin-4-ol
CID 19797304
[1-(6-cyclopentylpyridazin-3-yl)piperidin-4-yl]methanamine
CID 116972435
1-(6-chloropyridazin-3-yl)azepan-4-ol
CID 130608611
3-cyclopropyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyridazine
CID 171327910
1-(6-cyclobutylpyridazin-3-yl)-N-methylpyrrolidin-3-amine
CID 116972984

Frequently Asked Questions

What is the IUPAC name of 1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol?
The IUPAC name of 1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol (CID 116972763) is 1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol.
What is the SMILES notation for 1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol?
The canonical SMILES for 1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol is CN1CCC(c2ccc(N3CCC(O)CC3)nn2)C1.
What is the InChIKey of 1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol?
The InChIKey is OZDHAMPNWCAWFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-17-7-4-11(10-17)13-2-3-14(16-15-13)18-8-5-12(19)6-9-18/h2-3,11-12,19H,4-10H2,1H3.
What are the key properties of 1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol?
1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol has a molecular weight of 262.36 g/mol, XLogP of 0.86, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]piperidin-4-ol is sourced from PubChem (CID 116972763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).