7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane

C17H25NO — CID 65211245

IUPAC7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane
SMILESCC1(CCc2ccccc2)CNCC2(CCCC2)O1
InChIInChI=1S/C17H25NO/c1-16(12-9-15-7-3-2-4-8-15)13-18-14-17(19-16)10-5-6-11-17/h2-4,7-8,18H,5-6,9-14H2,1H3
InChIKeyUZUWBPVBPCMTDV-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.31
Rot. Bonds3

About 7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane

7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane (PubChem CID 65211245) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane.

Molecular Properties

Compound Name7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane
PubChem CID65211245
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane
SMILESCC1(CCc2ccccc2)CNCC2(CCCC2)O1
InChIInChI=1S/C17H25NO/c1-16(12-9-15-7-3-2-4-8-15)13-18-14-17(19-16)10-5-6-11-17/h2-4,7-8,18H,5-6,9-14H2,1H3
InChIKeyUZUWBPVBPCMTDV-UHFFFAOYSA-N
XLogP3.31
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane?
The IUPAC name of 7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane (CID 65211245) is 7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane.
What is the SMILES notation for 7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane?
The canonical SMILES for 7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane is CC1(CCc2ccccc2)CNCC2(CCCC2)O1.
What is the InChIKey of 7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane?
The InChIKey is UZUWBPVBPCMTDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-16(12-9-15-7-3-2-4-8-15)13-18-14-17(19-16)10-5-6-11-17/h2-4,7-8,18H,5-6,9-14H2,1H3.
What are the key properties of 7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane?
7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane has a molecular weight of 259.39 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-7-(2-phenylethyl)-6-oxa-9-azaspiro[4.5]decane is sourced from PubChem (CID 65211245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).