2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol

C18H26O2 — CID 63466658

IUPAC2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)C(Oc2ccc3c(c2)CCC3)C1
InChIInChI=1S/C18H26O2/c1-2-4-13-7-10-17(19)18(11-13)20-16-9-8-14-5-3-6-15(14)12-16/h8-9,12-13,17-19H,2-7,10-11H2,1H3
InChIKeyLNOSUONSKCXWMN-UHFFFAOYSA-N
MW274.40 g/mol
LogP3.88
Rot. Bonds4

About 2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol

2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol (PubChem CID 63466658) has the molecular formula C18H26O2 and a molecular weight of 274.40 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol
PubChem CID63466658
Molecular FormulaC18H26O2
Molecular Weight274.40 g/mol
Exact Mass274.19
IUPAC Name2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)C(Oc2ccc3c(c2)CCC3)C1
InChIInChI=1S/C18H26O2/c1-2-4-13-7-10-17(19)18(11-13)20-16-9-8-14-5-3-6-15(14)12-16/h8-9,12-13,17-19H,2-7,10-11H2,1H3
InChIKeyLNOSUONSKCXWMN-UHFFFAOYSA-N
XLogP3.88
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.40
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol (CID 63466658) is 2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol is CCCC1CCC(O)C(Oc2ccc3c(c2)CCC3)C1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol?
The InChIKey is LNOSUONSKCXWMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26O2/c1-2-4-13-7-10-17(19)18(11-13)20-16-9-8-14-5-3-6-15(14)12-16/h8-9,12-13,17-19H,2-7,10-11H2,1H3.
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol?
2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol has a molecular weight of 274.40 g/mol, XLogP of 3.88, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol is sourced from PubChem (CID 63466658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).