(2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol

C14H26O2 — CID 115801768

IUPAC(2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol
SMILESCCC1CCCCC1C(O)C1COC(C)C1
InChIInChI=1S/C14H26O2/c1-3-11-6-4-5-7-13(11)14(15)12-8-10(2)16-9-12/h10-15H,3-9H2,1-2H3
InChIKeyXXUIVCCTDJHGAG-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.99
Rot. Bonds3

About (2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol

(2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol (PubChem CID 115801768) has the molecular formula C14H26O2 and a molecular weight of 226.36 g/mol. Its IUPAC name is (2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol.

Molecular Properties

Compound Name(2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol
PubChem CID115801768
Molecular FormulaC14H26O2
Molecular Weight226.36 g/mol
Exact Mass226.19
IUPAC Name(2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol
SMILESCCC1CCCCC1C(O)C1COC(C)C1
InChIInChI=1S/C14H26O2/c1-3-11-6-4-5-7-13(11)14(15)12-8-10(2)16-9-12/h10-15H,3-9H2,1-2H3
InChIKeyXXUIVCCTDJHGAG-UHFFFAOYSA-N
XLogP2.99
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(Oxolan-2-ylmethyl)heptan-2-ol
CID 551274
5-Methyl-6-(oxolan-2-yl)hexan-2-ol
CID 3611923
3-(3-Methyloxolan-2-yl)propan-1-ol
CID 130129962
3A,7A-Dimethyloctahydro-4-isobenzofuranol
CID 41057
(7-Oxabicyclo[2.2.1]heptane-2,3-diyl)dimethanol
CID 303432
3-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxypropan-1-ol
CID 9920788
[(1S,4R)-3-(hydroxymethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]methanol
CID 70439866
1,4-Pentanediol, 1-cyclohexyl-
CID 11446772
cis-(1R,2S)-2-[(2R,3R)-2-methyloxan-3-yl]cyclohexan-1-ol
CID 14611759
cis-(1S,2R)-2-[(2R,3R)-2-methyloxan-3-yl]cyclohexan-1-ol
CID 14611760
(2R,4R)-4-[(1R)-1-cyclohexylbutoxy]pentan-2-ol
CID 14923538
(2R,4R)-4-[(1S)-1-cyclohexylbutoxy]pentan-2-ol
CID 14923539

Frequently Asked Questions

What is the IUPAC name of (2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol?
The IUPAC name of (2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol (CID 115801768) is (2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol.
What is the SMILES notation for (2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol?
The canonical SMILES for (2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol is CCC1CCCCC1C(O)C1COC(C)C1.
What is the InChIKey of (2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol?
The InChIKey is XXUIVCCTDJHGAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O2/c1-3-11-6-4-5-7-13(11)14(15)12-8-10(2)16-9-12/h10-15H,3-9H2,1-2H3.
What are the key properties of (2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol?
(2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol has a molecular weight of 226.36 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylcyclohexyl)-(5-methyloxolan-3-yl)methanol is sourced from PubChem (CID 115801768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).