3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol

C19H24O — CID 65149221

IUPAC3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol
SMILESCCC1CCCC(O)(Cc2cccc3ccccc23)C1
InChIInChI=1S/C19H24O/c1-2-15-7-6-12-19(20,13-15)14-17-10-5-9-16-8-3-4-11-18(16)17/h3-5,8-11,15,20H,2,6-7,12-14H2,1H3
InChIKeyACMUGGXVANDJAJ-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.71
Rot. Bonds3

About 3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol

3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol (PubChem CID 65149221) has the molecular formula C19H24O and a molecular weight of 268.40 g/mol. Its IUPAC name is 3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol
PubChem CID65149221
Molecular FormulaC19H24O
Molecular Weight268.40 g/mol
Exact Mass268.18
IUPAC Name3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol
SMILESCCC1CCCC(O)(Cc2cccc3ccccc23)C1
InChIInChI=1S/C19H24O/c1-2-15-7-6-12-19(20,13-15)14-17-10-5-9-16-8-3-4-11-18(16)17/h3-5,8-11,15,20H,2,6-7,12-14H2,1H3
InChIKeyACMUGGXVANDJAJ-UHFFFAOYSA-N
XLogP4.71
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol?
The IUPAC name of 3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol (CID 65149221) is 3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol.
What is the SMILES notation for 3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol?
The canonical SMILES for 3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol is CCC1CCCC(O)(Cc2cccc3ccccc23)C1.
What is the InChIKey of 3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol?
The InChIKey is ACMUGGXVANDJAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O/c1-2-15-7-6-12-19(20,13-15)14-17-10-5-9-16-8-3-4-11-18(16)17/h3-5,8-11,15,20H,2,6-7,12-14H2,1H3.
What are the key properties of 3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol?
3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol has a molecular weight of 268.40 g/mol, XLogP of 4.71, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol is sourced from PubChem (CID 65149221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).