(1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol

C17H30O2 — CID 106830968

IUPAC(1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol
SMILESCC1(C(O)C2CCOC3(CCCC3)C2)CCCCC1
InChIInChI=1S/C17H30O2/c1-16(8-3-2-4-9-16)15(18)14-7-12-19-17(13-14)10-5-6-11-17/h14-15,18H,2-13H2,1H3
InChIKeyPCXMQLHVUYJDDF-UHFFFAOYSA-N
MW266.42 g/mol
LogP4.06
Rot. Bonds2

About (1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol

(1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol (PubChem CID 106830968) has the molecular formula C17H30O2 and a molecular weight of 266.42 g/mol. Its IUPAC name is (1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol.

Molecular Properties

Compound Name(1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol
PubChem CID106830968
Molecular FormulaC17H30O2
Molecular Weight266.42 g/mol
Exact Mass266.22
IUPAC Name(1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol
SMILESCC1(C(O)C2CCOC3(CCCC3)C2)CCCCC1
InChIInChI=1S/C17H30O2/c1-16(8-3-2-4-9-16)15(18)14-7-12-19-17(13-14)10-5-6-11-17/h14-15,18H,2-13H2,1H3
InChIKeyPCXMQLHVUYJDDF-UHFFFAOYSA-N
XLogP4.06
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
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-methylcyclohexyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methanol
CID 106830971
2-methyl-1-(1-oxaspiro[5.5]undecan-4-yl)propan-1-ol
CID 79901248
cyclopropyl(1-oxaspiro[5.5]undecan-4-yl)methanol
CID 79912354
(2-methylthiolan-2-yl)-(6-oxaspiro[4.5]decan-9-yl)methanol
CID 105116291
[1-(dimethylamino)cyclopentyl]-(5-oxaspiro[3.5]nonan-8-yl)methanol
CID 79921401
1-[1,9-dioxaspiro[5.5]undecan-4-yl(hydroxy)methyl]cyclohexan-1-ol
CID 103451663
1-cyclohexyl-2-(5-oxaspiro[3.5]nonan-8-yl)ethane-1,2-diol
CID 103459246
(4,4-dimethylcyclohexyl)-(1-oxaspiro[5.5]undecan-4-yl)methanamine
CID 79910537
2,2,2-trifluoro-1-(1-oxaspiro[5.5]undecan-4-yl)ethanol
CID 79921916
2-(1-oxaspiro[5.5]undecan-4-yl)propanoic acid
CID 79901459
cyclohexyl(5-oxaspiro[3.5]nonan-8-yl)methanol
CID 79899192
3-(5-oxaspiro[3.5]nonan-8-yl)butan-2-ol
CID 79911578

Frequently Asked Questions

What is the IUPAC name of (1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol?
The IUPAC name of (1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol (CID 106830968) is (1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol.
What is the SMILES notation for (1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol?
The canonical SMILES for (1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol is CC1(C(O)C2CCOC3(CCCC3)C2)CCCCC1.
What is the InChIKey of (1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol?
The InChIKey is PCXMQLHVUYJDDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30O2/c1-16(8-3-2-4-9-16)15(18)14-7-12-19-17(13-14)10-5-6-11-17/h14-15,18H,2-13H2,1H3.
What are the key properties of (1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol?
(1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol has a molecular weight of 266.42 g/mol, XLogP of 4.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanol is sourced from PubChem (CID 106830968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).