3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene

C15H20N2O — CID 91595851

IUPAC3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene
SMILESC1=C(CCc2ccccc2)NOC12CCNCC2
InChIInChI=1S/C15H20N2O/c1-2-4-13(5-3-1)6-7-14-12-15(18-17-14)8-10-16-11-9-15/h1-5,12,16-17H,6-11H2
InChIKeyHSFOLSQYGVAOFR-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.16
Rot. Bonds3

About 3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene

3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene (PubChem CID 91595851) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene.

Molecular Properties

Compound Name3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene
PubChem CID91595851
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene
SMILESC1=C(CCc2ccccc2)NOC12CCNCC2
InChIInChI=1S/C15H20N2O/c1-2-4-13(5-3-1)6-7-14-12-15(18-17-14)8-10-16-11-9-15/h1-5,12,16-17H,6-11H2
InChIKeyHSFOLSQYGVAOFR-UHFFFAOYSA-N
XLogP2.16
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-phenyl-N-(3-piperidin-1-ylpropoxy)hexa-1,3-dien-3-amine
CID 57011050
4-(1-Oxa-2,8-diazaspiro[4.5]dec-3-en-3-yl)benzonitrile
CID 57162482
4-[(E)-2-phenylvinyl]piperidin-4-ol
CID 59003469
4-(2-Phenylethenyl)piperidin-4-ol
CID 69365652
Tert-butyl 3-benzyl-1-oxa-2,8-diazaspiro[4.5]dec-3-ene-8-carboxylate
CID 90704272
O-[(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-3-en-8-yl)] N-cyclooctylcarbamothioate
CID 90728388
3-Phenyl-1-oxa-2,9-diazaspiro[4.5]dec-3-ene
CID 90757823
3-Phenyl-1-oxa-2,7-diazaspiro[4.4]non-3-ene
CID 90811093
3-Bromo-8-(3-phenylpropyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene
CID 90871222
3-Bromo-8-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene
CID 90949097
Tert-butyl 3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene-8-carboxylate
CID 91076917
3-Phenyl-1-oxa-2,9-diazaspiro[4.6]undec-3-ene
CID 91077605

Frequently Asked Questions

What is the IUPAC name of 3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene?
The IUPAC name of 3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene (CID 91595851) is 3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene.
What is the SMILES notation for 3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene?
The canonical SMILES for 3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene is C1=C(CCc2ccccc2)NOC12CCNCC2.
What is the InChIKey of 3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene?
The InChIKey is HSFOLSQYGVAOFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-2-4-13(5-3-1)6-7-14-12-15(18-17-14)8-10-16-11-9-15/h1-5,12,16-17H,6-11H2.
What are the key properties of 3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene?
3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene has a molecular weight of 244.34 g/mol, XLogP of 2.16, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-phenylethyl)-1-oxa-2,8-diazaspiro[4.5]dec-3-ene is sourced from PubChem (CID 91595851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).