15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane

C16H28NO- — CID 140701768

IUPAC15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane
SMILESCC1CC2(CCCCC2)N([O-])C2(CCCCC2)C1
InChIInChI=1S/C16H28NO/c1-14-12-15(8-4-2-5-9-15)17(18)16(13-14)10-6-3-7-11-16/h14H,2-13H2,1H3/q-1
InChIKeyQPBFXBKYBMWFHR-UHFFFAOYSA-N
MW250.41 g/mol
LogP4.62
Rot. Bonds

About 15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane

15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane (PubChem CID 140701768) has the molecular formula C16H28NO- and a molecular weight of 250.41 g/mol. Its IUPAC name is 15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane.

Molecular Properties

Compound Name15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane
PubChem CID140701768
Molecular FormulaC16H28NO-
Molecular Weight250.41 g/mol
Exact Mass250.22
IUPAC Name15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane
SMILESCC1CC2(CCCCC2)N([O-])C2(CCCCC2)C1
InChIInChI=1S/C16H28NO/c1-14-12-15(8-4-2-5-9-15)17(18)16(13-14)10-6-3-7-11-16/h14H,2-13H2,1H3/q-1
InChIKeyQPBFXBKYBMWFHR-UHFFFAOYSA-N
XLogP4.62
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-tert-butyl-11-methyl-5-azadispiro[3.1.36.34]dodecane
CID 177123718
ethane;2-methylspiro[3.5]nonane
CID 164868147
(5R,8S)-1,8-dimethyl-1-azaspiro[4.4]nonane
CID 169125835
(7R)-2,5,7-trimethyl-5-azaspiro[3.4]octane
CID 178101476
7-methoxy-14-methyl-7-azadispiro[5.1.58.26]pentadecane
CID 137448609
(8S)-5-cyclopropyl-8-methyl-5-azaspiro[3.5]nonane;ethane
CID 169125922
(3R)-3-methylspiro[4.5]decane
CID 140778087
(9R)-6-iodo-9-methyl-6-azaspiro[4.6]undecane
CID 145095630
CID 140958837
CID 140958837
1-(3-methyl-1-bicyclo[3.3.1]nonanyl)piperazine
CID 166955946
CID 59919159
CID 59919159
8-methyl-10,11,12-trioxatricyclo[4.3.2.11,6]dodecane
CID 138502243

Frequently Asked Questions

What is the IUPAC name of 15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane?
The IUPAC name of 15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane (CID 140701768) is 15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane.
What is the SMILES notation for 15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane?
The canonical SMILES for 15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane is CC1CC2(CCCCC2)N([O-])C2(CCCCC2)C1.
What is the InChIKey of 15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane?
The InChIKey is QPBFXBKYBMWFHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28NO/c1-14-12-15(8-4-2-5-9-15)17(18)16(13-14)10-6-3-7-11-16/h14H,2-13H2,1H3/q-1.
What are the key properties of 15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane?
15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane has a molecular weight of 250.41 g/mol, XLogP of 4.62, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 15-methyl-7-oxido-7-azadispiro[5.1.58.36]hexadecane is sourced from PubChem (CID 140701768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).