cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone

C19H24N2O2 — CID 134788133

IUPACcyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone
SMILESO=C(C1CCCC1)N1CCC2(CC1)CC(c1ccccc1)=NO2
InChIInChI=1S/C19H24N2O2/c22-18(16-8-4-5-9-16)21-12-10-19(11-13-21)14-17(20-23-19)15-6-2-1-3-7-15/h1-3,6-7,16H,4-5,8-14H2
InChIKeyHHXLWYZMECZGCD-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.36
Rot. Bonds2

About cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone

cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone (PubChem CID 134788133) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone.

Molecular Properties

Compound Namecyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone
PubChem CID134788133
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Namecyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone
SMILESO=C(C1CCCC1)N1CCC2(CC1)CC(c1ccccc1)=NO2
InChIInChI=1S/C19H24N2O2/c22-18(16-8-4-5-9-16)21-12-10-19(11-13-21)14-17(20-23-19)15-6-2-1-3-7-15/h1-3,6-7,16H,4-5,8-14H2
InChIKeyHHXLWYZMECZGCD-UHFFFAOYSA-N
XLogP3.36
TPSA41.90 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone?
The IUPAC name of cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone (CID 134788133) is cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone.
What is the SMILES notation for cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone?
The canonical SMILES for cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone is O=C(C1CCCC1)N1CCC2(CC1)CC(c1ccccc1)=NO2.
What is the InChIKey of cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone?
The InChIKey is HHXLWYZMECZGCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c22-18(16-8-4-5-9-16)21-12-10-19(11-13-21)14-17(20-23-19)15-6-2-1-3-7-15/h1-3,6-7,16H,4-5,8-14H2.
What are the key properties of cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone?
cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone has a molecular weight of 312.41 g/mol, XLogP of 3.36, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)methanone is sourced from PubChem (CID 134788133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).