1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one

C15H24O3 — CID 66368660

IUPAC1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one
SMILESO=C1CC(OCC2CCCO2)C12CCCCCC2
InChIInChI=1S/C15H24O3/c16-13-10-14(18-11-12-6-5-9-17-12)15(13)7-3-1-2-4-8-15/h12,14H,1-11H2
InChIKeyZOMIPLMWVXNFJE-UHFFFAOYSA-N
MW252.35 g/mol
LogP2.86
Rot. Bonds3

About 1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one

1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one (PubChem CID 66368660) has the molecular formula C15H24O3 and a molecular weight of 252.35 g/mol. Its IUPAC name is 1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one.

Molecular Properties

Compound Name1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one
PubChem CID66368660
Molecular FormulaC15H24O3
Molecular Weight252.35 g/mol
Exact Mass252.17
IUPAC Name1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one
SMILESO=C1CC(OCC2CCCO2)C12CCCCCC2
InChIInChI=1S/C15H24O3/c16-13-10-14(18-11-12-6-5-9-17-12)15(13)7-3-1-2-4-8-15/h12,14H,1-11H2
InChIKeyZOMIPLMWVXNFJE-UHFFFAOYSA-N
XLogP2.86
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.35
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopropylmethoxy)spiro[3.5]nonan-3-one
CID 66367438
1-(cyclohexylmethoxy)spiro[3.4]octan-3-one
CID 66368904
2-[(3-bromospiro[3.4]octan-1-yl)oxymethyl]oxolane
CID 66343412
3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol
CID 66368745
3-(oxolan-2-ylmethoxy)cyclopentan-1-one
CID 79643554
3-(oxan-2-ylmethoxy)cyclohexan-1-one
CID 79618470
2-[(3-bromo-2-ethyl-2-methylcyclobutyl)oxymethyl]oxolane
CID 66344041
2-[(3-chloro-2,2-dimethylcyclobutyl)oxymethyl]oxolane
CID 66343624
oxolan-2-ylmethyl hypochlorite
CID 22491519
1-[(4-methoxyphenyl)methoxy]spiro[3.6]decan-3-one
CID 66367641
1-(oxolan-2-ylmethoxymethyl)cyclohexan-1-amine
CID 64572264
2-[(3-chloro-2,2-diethylcyclobutyl)oxymethyl]oxolane
CID 66343413

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one?
The IUPAC name of 1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one (CID 66368660) is 1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one.
What is the SMILES notation for 1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one?
The canonical SMILES for 1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one is O=C1CC(OCC2CCCO2)C12CCCCCC2.
What is the InChIKey of 1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one?
The InChIKey is ZOMIPLMWVXNFJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O3/c16-13-10-14(18-11-12-6-5-9-17-12)15(13)7-3-1-2-4-8-15/h12,14H,1-11H2.
What are the key properties of 1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one?
1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one has a molecular weight of 252.35 g/mol, XLogP of 2.86, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-ylmethoxy)spiro[3.6]decan-3-one is sourced from PubChem (CID 66368660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).