3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol

C14H26O — CID 116539913

IUPAC3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol
SMILESCCC1CCC(C2(C)CCC(O)C2)CC1
InChIInChI=1S/C14H26O/c1-3-11-4-6-12(7-5-11)14(2)9-8-13(15)10-14/h11-13,15H,3-10H2,1-2H3
InChIKeyZPOUYNFINUXUFL-UHFFFAOYSA-N
MW210.36 g/mol
LogP3.75
Rot. Bonds2

About 3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol

3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol (PubChem CID 116539913) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is 3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol.

Molecular Properties

Compound Name3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol
PubChem CID116539913
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Name3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol
SMILESCCC1CCC(C2(C)CCC(O)C2)CC1
InChIInChI=1S/C14H26O/c1-3-11-4-6-12(7-5-11)14(2)9-8-13(15)10-14/h11-13,15H,3-10H2,1-2H3
InChIKeyZPOUYNFINUXUFL-UHFFFAOYSA-N
XLogP3.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol?
The IUPAC name of 3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol (CID 116539913) is 3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol.
What is the SMILES notation for 3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol?
The canonical SMILES for 3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol is CCC1CCC(C2(C)CCC(O)C2)CC1.
What is the InChIKey of 3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol?
The InChIKey is ZPOUYNFINUXUFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O/c1-3-11-4-6-12(7-5-11)14(2)9-8-13(15)10-14/h11-13,15H,3-10H2,1-2H3.
What are the key properties of 3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol?
3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol has a molecular weight of 210.36 g/mol, XLogP of 3.75, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylcyclohexyl)-3-methylcyclopentan-1-ol is sourced from PubChem (CID 116539913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).