cis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol

C14H27NO — CID 101492064

IUPACcis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol
SMILESCC(C)[C@]1(O)CCCC[C@@H]1N1CCCCC1
InChIInChI=1S/C14H27NO/c1-12(2)14(16)9-5-4-8-13(14)15-10-6-3-7-11-15/h12-13,16H,3-11H2,1-2H3/t13-,14+/m0/s1
InChIKeyWWLPEGSNHZDEQX-UONOGXRCSA-N
MW225.38 g/mol
LogP2.80
Rot. Bonds2

About cis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol

cis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol (PubChem CID 101492064) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is cis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Namecis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol
PubChem CID101492064
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Namecis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol
SMILESCC(C)[C@]1(O)CCCC[C@@H]1N1CCCCC1
InChIInChI=1S/C14H27NO/c1-12(2)14(16)9-5-4-8-13(14)15-10-6-3-7-11-15/h12-13,16H,3-11H2,1-2H3/t13-,14+/m0/s1
InChIKeyWWLPEGSNHZDEQX-UONOGXRCSA-N
XLogP2.80
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-Dimethyldecahydroquinolin-4-ol
CID 4038309
Piperidine, 1,2,5-trimethyl-4-hydroxy-4-butyl-
CID 603449
4-Quinolinol, 4-ethyldecahydro-1,2-dimethyl-, (2alpha,4beta,4aalpha,8abeta)-
CID 140686
4-Cyclohexyl-1-methylpiperid-4-ol
CID 115390
2-(1-Methylpiperidin-2-yl)propan-2-ol
CID 407808
1,2-Dimethyl-4-butyldecahydro-4-quinolol
CID 602872
2-[(2R)-1-methylpiperidin-2-yl]propan-2-ol
CID 92161206
1,4-Diethyl-2-methyldecahydro-4-quinolinol
CID 142277
2-[(2S)-1-methylpiperidin-2-yl]propan-2-ol
CID 10057764
1-[(2S)-1-methylpiperidin-2-yl]cyclohexan-1-ol
CID 11820042
1-(1-Methylpiperidin-2-yl)cyclohexan-1-ol
CID 15758094
2-[(2S,4R)-4-tert-butyl-1-methylpiperidin-2-yl]propan-2-ol
CID 102008573

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol?
The IUPAC name of cis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol (CID 101492064) is cis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for cis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for cis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol is CC(C)[C@]1(O)CCCC[C@@H]1N1CCCCC1.
What is the InChIKey of cis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol?
The InChIKey is WWLPEGSNHZDEQX-UONOGXRCSA-N. The full InChI is InChI=1S/C14H27NO/c1-12(2)14(16)9-5-4-8-13(14)15-10-6-3-7-11-15/h12-13,16H,3-11H2,1-2H3/t13-,14+/m0/s1.
What are the key properties of cis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol?
cis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol has a molecular weight of 225.38 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-piperidin-1-yl-1-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 101492064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).