3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol

C17H30O2 — CID 115823243

IUPAC3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol
SMILESOC(CCC1CCCC1)C1CCOC2(CCCC2)C1
InChIInChI=1S/C17H30O2/c18-16(8-7-14-5-1-2-6-14)15-9-12-19-17(13-15)10-3-4-11-17/h14-16,18H,1-13H2
InChIKeyDHTMVWVDTNCQLP-UHFFFAOYSA-N
MW266.42 g/mol
LogP4.06
Rot. Bonds4

About 3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol

3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol (PubChem CID 115823243) has the molecular formula C17H30O2 and a molecular weight of 266.42 g/mol. Its IUPAC name is 3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol.

Molecular Properties

Compound Name3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol
PubChem CID115823243
Molecular FormulaC17H30O2
Molecular Weight266.42 g/mol
Exact Mass266.22
IUPAC Name3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol
SMILESOC(CCC1CCCC1)C1CCOC2(CCCC2)C1
InChIInChI=1S/C17H30O2/c18-16(8-7-14-5-1-2-6-14)15-9-12-19-17(13-15)10-3-4-11-17/h14-16,18H,1-13H2
InChIKeyDHTMVWVDTNCQLP-UHFFFAOYSA-N
XLogP4.06
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.42
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(6-oxaspiro[4.5]decan-9-yl)hexan-1-ol
CID 79912927
1-(6-oxaspiro[4.5]decan-9-yl)heptan-1-ol
CID 79913392
2,2,2-trifluoro-1-(6-oxaspiro[4.5]decan-9-yl)ethanol
CID 79921915
3-cyclohexyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)propan-1-amine
CID 105017958
cyclopropyl(1-oxaspiro[5.5]undecan-4-yl)methanol
CID 79912354
1-cyclohexyl-2-(5-oxaspiro[3.5]nonan-8-yl)ethane-1,2-diol
CID 103459246
2,2,2-trifluoro-1-(1-oxaspiro[5.5]undecan-4-yl)ethanol
CID 79921916
2-cyclobutyl-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
CID 103169206
2-(1,1-dioxothiolan-3-yl)-1-(5-oxaspiro[3.5]nonan-8-yl)ethanol
CID 105112720
4,4,4-trifluoro-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butan-1-ol
CID 79954233
1-(6-oxaspiro[4.5]decan-9-yl)-2-(propylamino)ethanol
CID 79924322
2-methyl-1-(1-oxaspiro[5.5]undecan-4-yl)propan-1-ol
CID 79901248

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol?
The IUPAC name of 3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol (CID 115823243) is 3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol.
What is the SMILES notation for 3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol?
The canonical SMILES for 3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol is OC(CCC1CCCC1)C1CCOC2(CCCC2)C1.
What is the InChIKey of 3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol?
The InChIKey is DHTMVWVDTNCQLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30O2/c18-16(8-7-14-5-1-2-6-14)15-9-12-19-17(13-15)10-3-4-11-17/h14-16,18H,1-13H2.
What are the key properties of 3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol?
3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol has a molecular weight of 266.42 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-ol is sourced from PubChem (CID 115823243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).