8-methyl-5-oxa-8-azaspiro[3.4]octane

C7H13NO — CID 123313806

IUPAC8-methyl-5-oxa-8-azaspiro[3.4]octane
SMILESCN1CCOC12CCC2
InChIInChI=1S/C7H13NO/c1-8-5-6-9-7(8)3-2-4-7/h2-6H2,1H3
InChIKeyHNPOTIVNUJPSEQ-UHFFFAOYSA-N
MW127.19 g/mol
LogP0.83
Rot. Bonds

About 8-methyl-5-oxa-8-azaspiro[3.4]octane

8-methyl-5-oxa-8-azaspiro[3.4]octane (PubChem CID 123313806) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is 8-methyl-5-oxa-8-azaspiro[3.4]octane.

Molecular Properties

Compound Name8-methyl-5-oxa-8-azaspiro[3.4]octane
PubChem CID123313806
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name8-methyl-5-oxa-8-azaspiro[3.4]octane
SMILESCN1CCOC12CCC2
InChIInChI=1S/C7H13NO/c1-8-5-6-9-7(8)3-2-4-7/h2-6H2,1H3
InChIKeyHNPOTIVNUJPSEQ-UHFFFAOYSA-N
XLogP0.83
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;5-methyl-1-oxa-5-azaspiro[3.3]heptane
CID 144685724
4-methyl-8-penta-2,4-dien-2-ylsulfonyl-1-oxa-4,8-diazaspiro[4.5]decane
CID 123190341
2,2-difluoro-3-methyl-1,3-oxazolidine
CID 67205796
5-methyl-8-oxa-5-azaspiro[3.5]nonane
CID 130359992
2,3-dimethyl-1,3-oxazolidin-2-amine
CID 67867295
2-(1-oxa-4-azaspiro[4.6]undecan-4-yl)ethanol
CID 13270979
(9-methyl-1-oxa-4,9-diazaspiro[4.5]decan-4-yl)methanethiol
CID 123337041
1-ethyl-5-oxa-1-azaspiro[3.4]octane
CID 144689106
8-propan-2-yl-5-oxa-8-azaspiro[3.6]decane
CID 167444220
1-methyl-1-azaspiro[3.3]heptane
CID 118001601
4-sulfanyl-1-oxa-4,9-diazaspiro[4.5]decane
CID 91336838
4-methyl-1-oxa-4-azaspiro[5.5]undecane
CID 23544679

Frequently Asked Questions

What is the IUPAC name of 8-methyl-5-oxa-8-azaspiro[3.4]octane?
The IUPAC name of 8-methyl-5-oxa-8-azaspiro[3.4]octane (CID 123313806) is 8-methyl-5-oxa-8-azaspiro[3.4]octane.
What is the SMILES notation for 8-methyl-5-oxa-8-azaspiro[3.4]octane?
The canonical SMILES for 8-methyl-5-oxa-8-azaspiro[3.4]octane is CN1CCOC12CCC2.
What is the InChIKey of 8-methyl-5-oxa-8-azaspiro[3.4]octane?
The InChIKey is HNPOTIVNUJPSEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-8-5-6-9-7(8)3-2-4-7/h2-6H2,1H3.
What are the key properties of 8-methyl-5-oxa-8-azaspiro[3.4]octane?
8-methyl-5-oxa-8-azaspiro[3.4]octane has a molecular weight of 127.19 g/mol, XLogP of 0.83, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-5-oxa-8-azaspiro[3.4]octane is sourced from PubChem (CID 123313806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).