cis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol

C16H18O — CID 68819847

IUPACcis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol
SMILESO[C@@H]1CCCC[C@@H]1c1ccc2ccccc2c1
InChIInChI=1S/C16H18O/c17-16-8-4-3-7-15(16)14-10-9-12-5-1-2-6-13(12)11-14/h1-2,5-6,9-11,15-17H,3-4,7-8H2/t15-,16-/m1/s1
InChIKeySJHHKRLBAHTTOU-HZPDHXFCSA-N
MW226.32 g/mol
LogP3.86
Rot. Bonds1

About cis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol

cis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol (PubChem CID 68819847) has the molecular formula C16H18O and a molecular weight of 226.32 g/mol. Its IUPAC name is cis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Namecis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol
PubChem CID68819847
Molecular FormulaC16H18O
Molecular Weight226.32 g/mol
Exact Mass226.14
IUPAC Namecis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol
SMILESO[C@@H]1CCCC[C@@H]1c1ccc2ccccc2c1
InChIInChI=1S/C16H18O/c17-16-8-4-3-7-15(16)14-10-9-12-5-1-2-6-13(12)11-14/h1-2,5-6,9-11,15-17H,3-4,7-8H2/t15-,16-/m1/s1
InChIKeySJHHKRLBAHTTOU-HZPDHXFCSA-N
XLogP3.86
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol?
The IUPAC name of cis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol (CID 68819847) is cis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol.
What is the SMILES notation for cis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol?
The canonical SMILES for cis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol is O[C@@H]1CCCC[C@@H]1c1ccc2ccccc2c1.
What is the InChIKey of cis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol?
The InChIKey is SJHHKRLBAHTTOU-HZPDHXFCSA-N. The full InChI is InChI=1S/C16H18O/c17-16-8-4-3-7-15(16)14-10-9-12-5-1-2-6-13(12)11-14/h1-2,5-6,9-11,15-17H,3-4,7-8H2/t15-,16-/m1/s1.
What are the key properties of cis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol?
cis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol has a molecular weight of 226.32 g/mol, XLogP of 3.86, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2R)-2-naphthalen-2-ylcyclohexan-1-ol is sourced from PubChem (CID 68819847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).