1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione

C18H19N3O2 — CID 70645518

IUPAC1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione
SMILESCCCc1ccc2cc3c(cc2n1)CC1(C3)C(=O)NC(=O)N1C
InChIInChI=1S/C18H19N3O2/c1-3-4-14-6-5-11-7-12-9-18(10-13(12)8-15(11)19-14)16(22)20-17(23)21(18)2/h5-8H,3-4,9-10H2,1-2H3,(H,20,22,23)
InChIKeyKMAXNSHHRWSVQU-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.21
Rot. Bonds2

About 1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione

1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione (PubChem CID 70645518) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is 1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione.

Molecular Properties

Compound Name1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione
PubChem CID70645518
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC Name1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione
SMILESCCCc1ccc2cc3c(cc2n1)CC1(C3)C(=O)NC(=O)N1C
InChIInChI=1S/C18H19N3O2/c1-3-4-14-6-5-11-7-12-9-18(10-13(12)8-15(11)19-14)16(22)20-17(23)21(18)2/h5-8H,3-4,9-10H2,1-2H3,(H,20,22,23)
InChIKeyKMAXNSHHRWSVQU-UHFFFAOYSA-N
XLogP2.21
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione?
The IUPAC name of 1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione (CID 70645518) is 1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione.
What is the SMILES notation for 1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione?
The canonical SMILES for 1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione is CCCc1ccc2cc3c(cc2n1)CC1(C3)C(=O)NC(=O)N1C.
What is the InChIKey of 1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione?
The InChIKey is KMAXNSHHRWSVQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-3-4-14-6-5-11-7-12-9-18(10-13(12)8-15(11)19-14)16(22)20-17(23)21(18)2/h5-8H,3-4,9-10H2,1-2H3,(H,20,22,23).
What are the key properties of 1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione?
1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione has a molecular weight of 309.37 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-methyl-2-propylspiro[6,8-dihydrocyclopenta[g]quinoline-7,5'-imidazolidine]-2',4'-dione is sourced from PubChem (CID 70645518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).