8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane

C15H25NO — CID 137428847

IUPAC8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane
SMILESC=C1COC2(CCN(C)CC2)C1=CCCCC
InChIInChI=1S/C15H25NO/c1-4-5-6-7-14-13(2)12-17-15(14)8-10-16(3)11-9-15/h7H,2,4-6,8-12H2,1,3H3
InChIKeyGXFVBRFRJYHGPW-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.15
Rot. Bonds3

About 8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane

8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane (PubChem CID 137428847) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is 8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane
PubChem CID137428847
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane
SMILESC=C1COC2(CCN(C)CC2)C1=CCCCC
InChIInChI=1S/C15H25NO/c1-4-5-6-7-14-13(2)12-17-15(14)8-10-16(3)11-9-15/h7H,2,4-6,8-12H2,1,3H3
InChIKeyGXFVBRFRJYHGPW-UHFFFAOYSA-N
XLogP3.15
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2,8-Dimethyl-3-methylene-1-oxa-8-azaspiro(4,5)decane
CID 177233
(2R)-2,8-dimethyl-3-methylidene-1-oxa-8-azaspiro[4.5]decane
CID 10313386
2,8-Dimethyl-3-methylidene-1-oxa-8-azaspiro[4.5]decane;hydrochloride
CID 14852034
8-Methyl-3-methylidene-1-oxa-8-azaspiro[4.5]decane
CID 10352065
4-[(6-Fluorocyclohexa-1,5-dien-1-yl)methoxy]-1,4-dimethylpiperidine
CID 144279161
(S)-2,8-Dimethyl-3-methylene-1-oxa-8-azaspiro[4.5]decane
CID 6918122
(3Z)-3-ethylidene-2,8-dimethyl-1-oxa-8-azaspiro[4.5]decane
CID 19939730
3-Ethylidene-2,8-dimethyl-1-oxa-8-azaspiro[4.5]decane
CID 54297161
methyl (2Z)-2-(8-methyl-1-oxa-8-azaspiro[4.5]decan-3-ylidene)acetate
CID 67712847
Methyl 2-(8-methyl-1-oxa-8-azaspiro[4.5]decan-3-ylidene)acetate
CID 67712851
1'-methylspiro[3a,7a-dihydro-3H-1-benzofuran-2,4'-piperidine]
CID 91338235
8-ethyl-2-methyl-3,4-bis[(Z)-prop-1-enyl]-1-oxa-8-azaspiro[4.5]dec-3-ene
CID 130220142

Frequently Asked Questions

What is the IUPAC name of 8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane?
The IUPAC name of 8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane (CID 137428847) is 8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for 8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane is C=C1COC2(CCN(C)CC2)C1=CCCCC.
What is the InChIKey of 8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane?
The InChIKey is GXFVBRFRJYHGPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-4-5-6-7-14-13(2)12-17-15(14)8-10-16(3)11-9-15/h7H,2,4-6,8-12H2,1,3H3.
What are the key properties of 8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane?
8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane has a molecular weight of 235.37 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-3-methylidene-4-pentylidene-1-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 137428847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).