2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol

C12H23NO2 — CID 117003496

IUPAC2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol
SMILESOCCC1CCN(CC2CCCO2)CC1
InChIInChI=1S/C12H23NO2/c14-8-5-11-3-6-13(7-4-11)10-12-2-1-9-15-12/h11-12,14H,1-10H2
InChIKeyGMVVLVHMYUQXAK-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.26
Rot. Bonds4

About 2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol

2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol (PubChem CID 117003496) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol.

Molecular Properties

Compound Name2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol
PubChem CID117003496
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol
SMILESOCCC1CCN(CC2CCCO2)CC1
InChIInChI=1S/C12H23NO2/c14-8-5-11-3-6-13(7-4-11)10-12-2-1-9-15-12/h11-12,14H,1-10H2
InChIKeyGMVVLVHMYUQXAK-UHFFFAOYSA-N
XLogP1.26
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol
CID 94190741
2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]acetic acid
CID 79608204
2-[(3R)-1-[[(2S)-oxolan-2-yl]methyl]pyrrolidin-3-yl]acetic acid
CID 86324388
1-(iodomethyl)-4-(oxolan-2-ylmethyl)piperazine
CID 163911646
1-[4-(oxolan-2-ylmethyl)piperazin-1-yl]ethanone
CID 23402911
cyclobutyl-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]methanone
CID 94794131
1-(oxolan-2-ylmethyl)azetidin-3-amine
CID 63760708
2-[4-(oxolan-2-ylmethyl)piperazin-1-yl]acetic acid;hydrochloride
CID 67009184
N-[[1-(oxolan-2-ylmethyl)pyrrolidin-3-yl]methyl]propan-2-amine
CID 62513685
[3,3-dimethyl-1-(oxolan-2-ylmethyl)piperidin-4-yl]methanol
CID 117024917
1-(oxolan-2-ylmethyl)piperidine-4,4-dicarboxylic acid
CID 117007978
2-[1-[(4-methylmorpholin-2-yl)methyl]piperidin-3-yl]ethanol
CID 112734129

Frequently Asked Questions

What is the IUPAC name of 2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol?
The IUPAC name of 2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol (CID 117003496) is 2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol.
What is the SMILES notation for 2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol?
The canonical SMILES for 2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol is OCCC1CCN(CC2CCCO2)CC1.
What is the InChIKey of 2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol?
The InChIKey is GMVVLVHMYUQXAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c14-8-5-11-3-6-13(7-4-11)10-12-2-1-9-15-12/h11-12,14H,1-10H2.
What are the key properties of 2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol?
2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol has a molecular weight of 213.32 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol is sourced from PubChem (CID 117003496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).