4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol

C16H20N2O2 — CID 56760267

IUPAC4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol
SMILESOCC1(O)CCN(Cc2cccc3cccnc23)CC1
InChIInChI=1S/C16H20N2O2/c19-12-16(20)6-9-18(10-7-16)11-14-4-1-3-13-5-2-8-17-15(13)14/h1-5,8,19-20H,6-7,9-12H2
InChIKeyCUDVNTVAIDDUEG-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.55
Rot. Bonds3

About 4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol

4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol (PubChem CID 56760267) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol.

Molecular Properties

Compound Name4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol
PubChem CID56760267
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol
SMILESOCC1(O)CCN(Cc2cccc3cccnc23)CC1
InChIInChI=1S/C16H20N2O2/c19-12-16(20)6-9-18(10-7-16)11-14-4-1-3-13-5-2-8-17-15(13)14/h1-5,8,19-20H,6-7,9-12H2
InChIKeyCUDVNTVAIDDUEG-UHFFFAOYSA-N
XLogP1.55
TPSA56.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

8-(piperazin-1-ylmethyl)quinoline;dihydrochloride
CID 82025621
8-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]methyl]quinoline
CID 30385370
8-[(4-pyridin-2-ylpiperazin-1-yl)methyl]quinoline
CID 17451460
2-(quinolin-8-ylmethyl)-2,8-diazaspiro[4.5]decane
CID 120907566
1-(quinolin-8-ylmethyl)piperidine-4-carbaldehyde
CID 62654466
N'-hydroxy-1-(quinolin-8-ylmethyl)piperidine-4-carboximidamide
CID 77038510
1-(quinolin-8-ylmethyl)pyrrolidine-3-carboxylic acid
CID 63031197
3-phenyl-1-[4-(quinolin-8-ylmethyl)piperazin-1-yl]propan-1-one
CID 51336494
(4-phenylphenyl)-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone
CID 16609697
1-(quinolin-8-ylmethyl)piperidine-3-carboxylic acid
CID 43440675
8-[(3,3-dimethylpiperazin-1-yl)methyl]quinoline
CID 64832242
8-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]quinoline
CID 18168047

Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol?
The IUPAC name of 4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol (CID 56760267) is 4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol.
What is the SMILES notation for 4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol?
The canonical SMILES for 4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol is OCC1(O)CCN(Cc2cccc3cccnc23)CC1.
What is the InChIKey of 4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol?
The InChIKey is CUDVNTVAIDDUEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c19-12-16(20)6-9-18(10-7-16)11-14-4-1-3-13-5-2-8-17-15(13)14/h1-5,8,19-20H,6-7,9-12H2.
What are the key properties of 4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol?
4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol has a molecular weight of 272.35 g/mol, XLogP of 1.55, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-1-(quinolin-8-ylmethyl)piperidin-4-ol is sourced from PubChem (CID 56760267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).