1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol

C20H31NO — CID 5572

IUPAC1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol
SMILESOC(CCN1CCCCC1)(c1ccccc1)C1CCCCC1
InChIInChI=1S/C20H31NO/c22-20(18-10-4-1-5-11-18,19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21/h1,4-5,10-11,19,22H,2-3,6-9,12-17H2
InChIKeyHWHLPVGTWGOCJO-UHFFFAOYSA-N
MW301.47 g/mol
LogP4.33
Rot. Bonds5

About 1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol

1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol (PubChem CID 5572) has the molecular formula C20H31NO and a molecular weight of 301.47 g/mol. Its IUPAC name is 1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol.

Molecular Properties

Compound Name1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol
PubChem CID5572
Molecular FormulaC20H31NO
Molecular Weight301.47 g/mol
Exact Mass301.24
IUPAC Name1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol
SMILESOC(CCN1CCCCC1)(c1ccccc1)C1CCCCC1
InChIInChI=1S/C20H31NO/c22-20(18-10-4-1-5-11-18,19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21/h1,4-5,10-11,19,22H,2-3,6-9,12-17H2
InChIKeyHWHLPVGTWGOCJO-UHFFFAOYSA-N
XLogP4.33
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.47
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Biperiden
CID 2381
Procyclidine
CID 4919
Pridinol
CID 4904
Diphenidol
CID 3055
Trihexyphenidyl Hydrochloride
CID 66007
Azacyclonol
CID 15723
Diphenidol Hydrochloride
CID 66266
Biperiden Hydrochloride
CID 92151
Pipradrol
CID 10083
Procyclidine hydrochloride
CID 207841
Glemanserin
CID 71781
Cycrimine
CID 2911

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol?
The IUPAC name of 1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol (CID 5572) is 1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol.
What is the SMILES notation for 1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol?
The canonical SMILES for 1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol is OC(CCN1CCCCC1)(c1ccccc1)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol?
The InChIKey is HWHLPVGTWGOCJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31NO/c22-20(18-10-4-1-5-11-18,19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21/h1,4-5,10-11,19,22H,2-3,6-9,12-17H2.
What are the key properties of 1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol?
1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol has a molecular weight of 301.47 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol is sourced from PubChem (CID 5572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).