1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol

C15H29NO — CID 104968497

IUPAC1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol
SMILESC[C@@H]1CCC[C@H](C)N1CC(O)C1CCCCC1
InChIInChI=1S/C15H29NO/c1-12-7-6-8-13(2)16(12)11-15(17)14-9-4-3-5-10-14/h12-15,17H,3-11H2,1-2H3/t12-,13+,15?
InChIKeyUPWTXMBIFGNCIV-NNQSOWQGSA-N
MW239.40 g/mol
LogP3.19
Rot. Bonds3

About 1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol

1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol (PubChem CID 104968497) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol.

Molecular Properties

Compound Name1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol
PubChem CID104968497
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol
SMILESC[C@@H]1CCC[C@H](C)N1CC(O)C1CCCCC1
InChIInChI=1S/C15H29NO/c1-12-7-6-8-13(2)16(12)11-15(17)14-9-4-3-5-10-14/h12-15,17H,3-11H2,1-2H3/t12-,13+,15?
InChIKeyUPWTXMBIFGNCIV-NNQSOWQGSA-N
XLogP3.19
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol with MolForge

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Related Compounds

(2S)-1-(2,6-dimethylpiperidin-1-yl)propan-2-ol
CID 103934908
1-cyclopropyl-2-(2-methylpyrrolidin-1-yl)ethanol
CID 63905921
(2S)-1-amino-3-(2,6-dimethylpiperidin-1-yl)propan-2-ol
CID 130492440
1-cyclohexyl-2-(2-propan-2-ylpyrrolidin-1-yl)ethanol
CID 104752981
1-cyclohexyl-2-[4-(2-methylpropyl)piperazin-1-yl]ethanol
CID 104752803
1-cyclobutyl-2-pyrrolidin-1-ylethanol
CID 117245548
3-(2-methylazepan-1-yl)propane-1,2-diol
CID 82850957
(1R)-1-cyclohexylethane-1,2-diol
CID 11789331
(2S)-1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-3-[4-[(2S)-3-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-hydroxypropoxy]phenoxy]propan-2-ol
CID 124721948
1-cyclopentyl-2-(2,5-dimethylmorpholin-4-yl)ethanol
CID 104752531
2-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-1-cyclohexylethanol
CID 102727879
1-cyclohexyl-2-[dimethoxy(methyl)silyl]ethanol
CID 91181976

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol?
The IUPAC name of 1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol (CID 104968497) is 1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol.
What is the SMILES notation for 1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol?
The canonical SMILES for 1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol is C[C@@H]1CCC[C@H](C)N1CC(O)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol?
The InChIKey is UPWTXMBIFGNCIV-NNQSOWQGSA-N. The full InChI is InChI=1S/C15H29NO/c1-12-7-6-8-13(2)16(12)11-15(17)14-9-4-3-5-10-14/h12-15,17H,3-11H2,1-2H3/t12-,13+,15?.
What are the key properties of 1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol?
1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol has a molecular weight of 239.40 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanol is sourced from PubChem (CID 104968497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).