2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol

C14H26O2 — CID 79564056

IUPAC2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol
SMILESCC1CCCC(OCCC2CCCC2O)C1
InChIInChI=1S/C14H26O2/c1-11-4-2-6-13(10-11)16-9-8-12-5-3-7-14(12)15/h11-15H,2-10H2,1H3
InChIKeyFZZQQHGMRZOIRZ-UHFFFAOYSA-N
MW226.36 g/mol
LogP3.13
Rot. Bonds4

About 2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol

2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol (PubChem CID 79564056) has the molecular formula C14H26O2 and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol
PubChem CID79564056
Molecular FormulaC14H26O2
Molecular Weight226.36 g/mol
Exact Mass226.19
IUPAC Name2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol
SMILESCC1CCCC(OCCC2CCCC2O)C1
InChIInChI=1S/C14H26O2/c1-11-4-2-6-13(10-11)16-9-8-12-5-3-7-14(12)15/h11-15H,2-10H2,1H3
InChIKeyFZZQQHGMRZOIRZ-UHFFFAOYSA-N
XLogP3.13
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol?
The IUPAC name of 2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol (CID 79564056) is 2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol?
The canonical SMILES for 2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol is CC1CCCC(OCCC2CCCC2O)C1.
What is the InChIKey of 2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol?
The InChIKey is FZZQQHGMRZOIRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O2/c1-11-4-2-6-13(10-11)16-9-8-12-5-3-7-14(12)15/h11-15H,2-10H2,1H3.
What are the key properties of 2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol?
2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol has a molecular weight of 226.36 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-methylcyclohexyl)oxyethyl]cyclopentan-1-ol is sourced from PubChem (CID 79564056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).