(7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione

C16H19N3O2 — CID 68997935

IUPAC(7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione
SMILESCC1C=CC2=C(C=C3C[C@]4(CC3C2)C(=O)NC(=O)N4C)N1
InChIInChI=1S/C16H19N3O2/c1-9-3-4-10-5-11-7-16(8-12(11)6-13(10)17-9)14(20)18-15(21)19(16)2/h3-4,6,9,11,17H,5,7-8H2,1-2H3,(H,18,20,21)/t9?,11?,16-/m1/s1
InChIKeyXSLGTYXAHDLYSS-RPFRGFIWSA-N
MW285.35 g/mol
LogP1.45
Rot. Bonds

About (7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione

(7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione (PubChem CID 68997935) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is (7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione.

Molecular Properties

Compound Name(7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione
PubChem CID68997935
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name(7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione
SMILESCC1C=CC2=C(C=C3C[C@]4(CC3C2)C(=O)NC(=O)N4C)N1
InChIInChI=1S/C16H19N3O2/c1-9-3-4-10-5-11-7-16(8-12(11)6-13(10)17-9)14(20)18-15(21)19(16)2/h3-4,6,9,11,17H,5,7-8H2,1-2H3,(H,18,20,21)/t9?,11?,16-/m1/s1
InChIKeyXSLGTYXAHDLYSS-RPFRGFIWSA-N
XLogP1.45
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze (7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione 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 (7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione?
The IUPAC name of (7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione (CID 68997935) is (7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione.
What is the SMILES notation for (7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione?
The canonical SMILES for (7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione is CC1C=CC2=C(C=C3C[C@]4(CC3C2)C(=O)NC(=O)N4C)N1.
What is the InChIKey of (7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione?
The InChIKey is XSLGTYXAHDLYSS-RPFRGFIWSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-9-3-4-10-5-11-7-16(8-12(11)6-13(10)17-9)14(20)18-15(21)19(16)2/h3-4,6,9,11,17H,5,7-8H2,1-2H3,(H,18,20,21)/t9?,11?,16-/m1/s1.
What are the key properties of (7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione?
(7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione has a molecular weight of 285.35 g/mol, XLogP of 1.45, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-1',2-dimethylspiro[1,2,5,5a,6,8-hexahydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione is sourced from PubChem (CID 68997935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).