1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol

C17H30O3 — CID 79899722

IUPAC1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)(C2CCOC3(CCOC3)C2)CC1
InChIInChI=1S/C17H30O3/c1-2-3-14-4-7-17(18,8-5-14)15-6-10-20-16(12-15)9-11-19-13-16/h14-15,18H,2-13H2,1H3
InChIKeyOGYJFNQLCMOFLM-UHFFFAOYSA-N
MW282.42 g/mol
LogP3.29
Rot. Bonds3

About 1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol

1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol (PubChem CID 79899722) has the molecular formula C17H30O3 and a molecular weight of 282.42 g/mol. Its IUPAC name is 1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol.

Molecular Properties

Compound Name1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol
PubChem CID79899722
Molecular FormulaC17H30O3
Molecular Weight282.42 g/mol
Exact Mass282.22
IUPAC Name1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)(C2CCOC3(CCOC3)C2)CC1
InChIInChI=1S/C17H30O3/c1-2-3-14-4-7-17(18,8-5-14)15-6-10-20-16(12-15)9-11-19-13-16/h14-15,18H,2-13H2,1H3
InChIKeyOGYJFNQLCMOFLM-UHFFFAOYSA-N
XLogP3.29
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.42
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-(propylamino)cyclohexan-1-ol
CID 79907952
1-(2,6-dioxaspiro[4.5]decan-9-yl)cyclobutan-1-ol
CID 79912746
N-(4-propylcyclohexyl)-2,6-dioxaspiro[4.5]decan-9-amine
CID 79894869
1-(1,9-dioxaspiro[5.5]undecan-4-yl)-4-methylcyclohexan-1-ol
CID 79901774
4-(1,9-dioxaspiro[5.5]undecan-4-yl)-1-ethylpiperidin-4-ol
CID 79900930
3-amino-1-(2,6-dioxaspiro[4.5]decan-9-yl)cyclohexan-1-ol
CID 80561361
1-(1,9-dioxaspiro[5.5]undecan-4-yl)-4,4-dimethylcyclohexan-1-ol
CID 79912494
3-(2,6-dioxaspiro[4.5]decan-9-yl)piperidin-3-ol
CID 79902057
1-(3,5-dimethylcyclohexyl)-4-propylcyclohexan-1-ol
CID 64730670
4-(ethylamino)-1-(6-oxaspiro[4.5]decan-9-yl)cyclohexan-1-ol
CID 79922553
1-(2,6-dioxaspiro[4.5]decan-9-yl)hexan-3-amine
CID 79922713
1-(1-oxaspiro[5.5]undecan-4-yl)cyclohexan-1-ol
CID 79900915

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol?
The IUPAC name of 1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol (CID 79899722) is 1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol.
What is the SMILES notation for 1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol?
The canonical SMILES for 1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol is CCCC1CCC(O)(C2CCOC3(CCOC3)C2)CC1.
What is the InChIKey of 1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol?
The InChIKey is OGYJFNQLCMOFLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30O3/c1-2-3-14-4-7-17(18,8-5-14)15-6-10-20-16(12-15)9-11-19-13-16/h14-15,18H,2-13H2,1H3.
What are the key properties of 1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol?
1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol has a molecular weight of 282.42 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-propylcyclohexan-1-ol is sourced from PubChem (CID 79899722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).