2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol

C11H22N2O2 — CID 94190741

IUPAC2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol
SMILESOCCN1CCN(C[C@@H]2CCCO2)CC1
InChIInChI=1S/C11H22N2O2/c14-8-7-12-3-5-13(6-4-12)10-11-2-1-9-15-11/h11,14H,1-10H2/t11-/m0/s1
InChIKeyMYDIXFJYIXUPQL-NSHDSACASA-N
MW214.31 g/mol
LogP-0.22
Rot. Bonds4

About 2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol

2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol (PubChem CID 94190741) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol
PubChem CID94190741
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol
SMILESOCCN1CCN(C[C@@H]2CCCO2)CC1
InChIInChI=1S/C11H22N2O2/c14-8-7-12-3-5-13(6-4-12)10-11-2-1-9-15-11/h11,14H,1-10H2/t11-/m0/s1
InChIKeyMYDIXFJYIXUPQL-NSHDSACASA-N
XLogP-0.22
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[3-(oxolan-2-yl)propyl]-1,4-diazepan-1-yl]ethanol
CID 65166537
1-(2-chloroethyl)-4-(oxolan-2-ylmethyl)-1,4-diazepane
CID 63387476
3-[4-(oxolan-2-ylmethyl)piperazin-1-yl]propan-1-amine
CID 16768404
2-[1-(oxolan-2-ylmethyl)piperidin-4-yl]ethanol
CID 117003496
1-(iodomethyl)-4-(oxolan-2-ylmethyl)piperazine
CID 163911646
5-[4-(oxolan-2-ylmethyl)piperazin-1-yl]pentan-1-amine
CID 43253069
1-[4-(oxolan-2-ylmethyl)piperazin-1-yl]ethanone
CID 23402911
2-[4-(oxolan-2-ylmethyl)piperazin-1-yl]acetic acid;hydrochloride
CID 67009184
1-(2-chloroethyl)-4-(oxan-2-ylmethyl)-1,4-diazepane
CID 63387807
4-[4-(oxan-2-ylmethyl)piperazin-1-yl]butan-1-amine
CID 43591824
1-(2-methoxyethyl)-4-[[(2R)-oxan-2-yl]methyl]piperazine
CID 94532597
1-(2-methoxyethyl)-4-[[(2S)-oxan-2-yl]methyl]piperazine
CID 94532596

Frequently Asked Questions

What is the IUPAC name of 2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol?
The IUPAC name of 2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol (CID 94190741) is 2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol?
The canonical SMILES for 2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol is OCCN1CCN(C[C@@H]2CCCO2)CC1.
What is the InChIKey of 2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol?
The InChIKey is MYDIXFJYIXUPQL-NSHDSACASA-N. The full InChI is InChI=1S/C11H22N2O2/c14-8-7-12-3-5-13(6-4-12)10-11-2-1-9-15-11/h11,14H,1-10H2/t11-/m0/s1.
What are the key properties of 2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol?
2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol has a molecular weight of 214.31 g/mol, XLogP of -0.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]ethanol is sourced from PubChem (CID 94190741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).