5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione

C23H24N4O2 — CID 143468695

IUPAC5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione
SMILESCc1cc2nc(CNCc3ccccc3)ccc2cc1CC1C(=O)NC(=O)N1C
InChIInChI=1S/C23H24N4O2/c1-15-10-20-17(11-18(15)12-21-22(28)26-23(29)27(21)2)8-9-19(25-20)14-24-13-16-6-4-3-5-7-16/h3-11,21,24H,12-14H2,1-2H3,(H,26,28,29)
InChIKeyGUIIIBISWJVPDZ-UHFFFAOYSA-N
MW388.47 g/mol
LogP2.93
Rot. Bonds6

About 5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione

5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione (PubChem CID 143468695) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is 5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione
PubChem CID143468695
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC Name5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione
SMILESCc1cc2nc(CNCc3ccccc3)ccc2cc1CC1C(=O)NC(=O)N1C
InChIInChI=1S/C23H24N4O2/c1-15-10-20-17(11-18(15)12-21-22(28)26-23(29)27(21)2)8-9-19(25-20)14-24-13-16-6-4-3-5-7-16/h3-11,21,24H,12-14H2,1-2H3,(H,26,28,29)
InChIKeyGUIIIBISWJVPDZ-UHFFFAOYSA-N
XLogP2.93
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione?
The IUPAC name of 5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione (CID 143468695) is 5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione.
What is the SMILES notation for 5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione?
The canonical SMILES for 5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione is Cc1cc2nc(CNCc3ccccc3)ccc2cc1CC1C(=O)NC(=O)N1C.
What is the InChIKey of 5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione?
The InChIKey is GUIIIBISWJVPDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-15-10-20-17(11-18(15)12-21-22(28)26-23(29)27(21)2)8-9-19(25-20)14-24-13-16-6-4-3-5-7-16/h3-11,21,24H,12-14H2,1-2H3,(H,26,28,29).
What are the key properties of 5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione?
5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione has a molecular weight of 388.47 g/mol, XLogP of 2.93, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]methyl]-1-methylimidazolidine-2,4-dione is sourced from PubChem (CID 143468695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).