8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene

C14H18N2O — CID 11064249

IUPAC8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene
SMILESCN1CCC2(CC1)CC(c1ccccc1)=NO2
InChIInChI=1S/C14H18N2O/c1-16-9-7-14(8-10-16)11-13(15-17-14)12-5-3-2-4-6-12/h2-6H,7-11H2,1H3
InChIKeyLWCYFOWRXDNDCP-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.28
Rot. Bonds1

About 8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene

8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene (PubChem CID 11064249) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene.

Molecular Properties

Compound Name8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene
PubChem CID11064249
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene
SMILESCN1CCC2(CC1)CC(c1ccccc1)=NO2
InChIInChI=1S/C14H18N2O/c1-16-9-7-14(8-10-16)11-13(15-17-14)12-5-3-2-4-6-12/h2-6H,7-11H2,1H3
InChIKeyLWCYFOWRXDNDCP-UHFFFAOYSA-N
XLogP2.28
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene?
The IUPAC name of 8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene (CID 11064249) is 8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene.
What is the SMILES notation for 8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene?
The canonical SMILES for 8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene is CN1CCC2(CC1)CC(c1ccccc1)=NO2.
What is the InChIKey of 8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene?
The InChIKey is LWCYFOWRXDNDCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-16-9-7-14(8-10-16)11-13(15-17-14)12-5-3-2-4-6-12/h2-6H,7-11H2,1H3.
What are the key properties of 8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene?
8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene has a molecular weight of 230.31 g/mol, XLogP of 2.28, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene is sourced from PubChem (CID 11064249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).