(4-ethylcyclohexyl)-(furan-3-yl)methanol

C13H20O2 — CID 64749944

IUPAC(4-ethylcyclohexyl)-(furan-3-yl)methanol
SMILESCCC1CCC(C(O)c2ccoc2)CC1
InChIInChI=1S/C13H20O2/c1-2-10-3-5-11(6-4-10)13(14)12-7-8-15-9-12/h7-11,13-14H,2-6H2,1H3
InChIKeyRSHQKTSDEQUNLS-UHFFFAOYSA-N
MW208.30 g/mol
LogP3.53
Rot. Bonds3

About (4-ethylcyclohexyl)-(furan-3-yl)methanol

(4-ethylcyclohexyl)-(furan-3-yl)methanol (PubChem CID 64749944) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is (4-ethylcyclohexyl)-(furan-3-yl)methanol.

Molecular Properties

Compound Name(4-ethylcyclohexyl)-(furan-3-yl)methanol
PubChem CID64749944
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name(4-ethylcyclohexyl)-(furan-3-yl)methanol
SMILESCCC1CCC(C(O)c2ccoc2)CC1
InChIInChI=1S/C13H20O2/c1-2-10-3-5-11(6-4-10)13(14)12-7-8-15-9-12/h7-11,13-14H,2-6H2,1H3
InChIKeyRSHQKTSDEQUNLS-UHFFFAOYSA-N
XLogP3.53
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-ethylcyclohexyl)-(furan-3-yl)methanol?
The IUPAC name of (4-ethylcyclohexyl)-(furan-3-yl)methanol (CID 64749944) is (4-ethylcyclohexyl)-(furan-3-yl)methanol.
What is the SMILES notation for (4-ethylcyclohexyl)-(furan-3-yl)methanol?
The canonical SMILES for (4-ethylcyclohexyl)-(furan-3-yl)methanol is CCC1CCC(C(O)c2ccoc2)CC1.
What is the InChIKey of (4-ethylcyclohexyl)-(furan-3-yl)methanol?
The InChIKey is RSHQKTSDEQUNLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2/c1-2-10-3-5-11(6-4-10)13(14)12-7-8-15-9-12/h7-11,13-14H,2-6H2,1H3.
What are the key properties of (4-ethylcyclohexyl)-(furan-3-yl)methanol?
(4-ethylcyclohexyl)-(furan-3-yl)methanol has a molecular weight of 208.30 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylcyclohexyl)-(furan-3-yl)methanol is sourced from PubChem (CID 64749944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).