3-(cyclopropylmethoxy)cyclohexan-1-ol

C10H18O2 — CID 79618368

IUPAC3-(cyclopropylmethoxy)cyclohexan-1-ol
SMILESOC1CCCC(OCC2CC2)C1
InChIInChI=1S/C10H18O2/c11-9-2-1-3-10(6-9)12-7-8-4-5-8/h8-11H,1-7H2
InChIKeyMWQUZVODAONMBN-UHFFFAOYSA-N
MW170.25 g/mol
LogP1.72
Rot. Bonds3

About 3-(cyclopropylmethoxy)cyclohexan-1-ol

3-(cyclopropylmethoxy)cyclohexan-1-ol (PubChem CID 79618368) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 3-(cyclopropylmethoxy)cyclohexan-1-ol.

Molecular Properties

Compound Name3-(cyclopropylmethoxy)cyclohexan-1-ol
PubChem CID79618368
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name3-(cyclopropylmethoxy)cyclohexan-1-ol
SMILESOC1CCCC(OCC2CC2)C1
InChIInChI=1S/C10H18O2/c11-9-2-1-3-10(6-9)12-7-8-4-5-8/h8-11H,1-7H2
InChIKeyMWQUZVODAONMBN-UHFFFAOYSA-N
XLogP1.72
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylmethoxy)cyclohexan-1-ol?
The IUPAC name of 3-(cyclopropylmethoxy)cyclohexan-1-ol (CID 79618368) is 3-(cyclopropylmethoxy)cyclohexan-1-ol.
What is the SMILES notation for 3-(cyclopropylmethoxy)cyclohexan-1-ol?
The canonical SMILES for 3-(cyclopropylmethoxy)cyclohexan-1-ol is OC1CCCC(OCC2CC2)C1.
What is the InChIKey of 3-(cyclopropylmethoxy)cyclohexan-1-ol?
The InChIKey is MWQUZVODAONMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c11-9-2-1-3-10(6-9)12-7-8-4-5-8/h8-11H,1-7H2.
What are the key properties of 3-(cyclopropylmethoxy)cyclohexan-1-ol?
3-(cyclopropylmethoxy)cyclohexan-1-ol has a molecular weight of 170.25 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylmethoxy)cyclohexan-1-ol is sourced from PubChem (CID 79618368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).