[(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol

C11H23NO2 — CID 175634207

IUPAC[(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol
SMILESCC(C)OCCN1CCCC[C@H]1CO
InChIInChI=1S/C11H23NO2/c1-10(2)14-8-7-12-6-4-3-5-11(12)9-13/h10-11,13H,3-9H2,1-2H3/t11-/m0/s1
InChIKeyWEYXWMCDJFGCRM-NSHDSACASA-N
MW201.31 g/mol
LogP1.26
Rot. Bonds5

About [(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol

[(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol (PubChem CID 175634207) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is [(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol.

Molecular Properties

Compound Name[(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol
PubChem CID175634207
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name[(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol
SMILESCC(C)OCCN1CCCC[C@H]1CO
InChIInChI=1S/C11H23NO2/c1-10(2)14-8-7-12-6-4-3-5-11(12)9-13/h10-11,13H,3-9H2,1-2H3/t11-/m0/s1
InChIKeyWEYXWMCDJFGCRM-NSHDSACASA-N
XLogP1.26
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(2R)-1-[2-(2-methylpropoxy)ethyl]piperidin-2-yl]methanol
CID 100627976
[1-[2-(3-methylbutoxy)ethyl]piperidin-2-yl]methanol
CID 61355562
(1S)-1-[(2R)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]ethanol
CID 98759209
1-[2-(hydroxymethyl)piperidin-1-yl]-3-propan-2-yloxypropan-2-ol
CID 60635453
4-[2-(hydroxymethyl)azepan-1-yl]butan-2-ol
CID 116636768
propan-2-yl 3-[2-(hydroxymethyl)piperidin-1-yl]propanoate
CID 111487463
[1-(2-cycloheptyloxyethyl)piperidin-2-yl]methanol
CID 111448204
[1-[2-(3-methylbutoxy)ethyl]pyrrolidin-2-yl]methanol
CID 62013980
[1-(2-methoxyethyl)pyrrolidin-2-yl]methanol;sulfane
CID 159917406
[1-[2-(propan-2-ylamino)ethyl]azepan-2-yl]methanol
CID 116637148
[(2S)-1-(2-ethoxyethyl)pyrrolidin-2-yl]methanol
CID 112734321
[1-(4-methoxybutyl)azepan-2-yl]methanol
CID 116637260

Frequently Asked Questions

What is the IUPAC name of [(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol?
The IUPAC name of [(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol (CID 175634207) is [(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol.
What is the SMILES notation for [(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol?
The canonical SMILES for [(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol is CC(C)OCCN1CCCC[C@H]1CO.
What is the InChIKey of [(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol?
The InChIKey is WEYXWMCDJFGCRM-NSHDSACASA-N. The full InChI is InChI=1S/C11H23NO2/c1-10(2)14-8-7-12-6-4-3-5-11(12)9-13/h10-11,13H,3-9H2,1-2H3/t11-/m0/s1.
What are the key properties of [(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol?
[(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol has a molecular weight of 201.31 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-1-(2-propan-2-yloxyethyl)piperidin-2-yl]methanol is sourced from PubChem (CID 175634207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).