2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol

C17H23NO — CID 15925754

IUPAC2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol
SMILESOC1CCCCC1N1CC=C(c2ccccc2)CC1
InChIInChI=1S/C17H23NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,10,16-17,19H,4-5,8-9,11-13H2
InChIKeyNJNHOOFGKCHIFQ-UHFFFAOYSA-N
MW257.38 g/mol
LogP3.08
Rot. Bonds2

About 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol

2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol (PubChem CID 15925754) has the molecular formula C17H23NO and a molecular weight of 257.38 g/mol. Its IUPAC name is 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol
PubChem CID15925754
Molecular FormulaC17H23NO
Molecular Weight257.38 g/mol
Exact Mass257.18
IUPAC Name2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol
SMILESOC1CCCCC1N1CC=C(c2ccccc2)CC1
InChIInChI=1S/C17H23NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,10,16-17,19H,4-5,8-9,11-13H2
InChIKeyNJNHOOFGKCHIFQ-UHFFFAOYSA-N
XLogP3.08
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol?
The IUPAC name of 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol (CID 15925754) is 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol.
What is the SMILES notation for 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol?
The canonical SMILES for 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol is OC1CCCCC1N1CC=C(c2ccccc2)CC1.
What is the InChIKey of 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol?
The InChIKey is NJNHOOFGKCHIFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,10,16-17,19H,4-5,8-9,11-13H2.
What are the key properties of 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol?
2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol has a molecular weight of 257.38 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)cyclohexan-1-ol is sourced from PubChem (CID 15925754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).