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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Related Compounds

N-[3-[2-[2-[(benzylamino)methyl]-7-methylquinolin-6-yl]ethyl]-2-pyridinyl]formamide
CID 143468847
(5S)-5-benzyl-1-methylimidazolidine-2,4-dione
CID 165148051
N-[[6-[(benzylamino)methyl]-2-pyridinyl]methyl]-1-phenylmethanamine
CID 11639693
3-[(benzylamino)methyl]-7,8-dimethyl-1H-quinolin-2-one
CID 864730
7-[2-(benzylamino)ethyl]-8-bromo-3-methyl-4,5-dihydropurine-2,6-dione
CID 78317477
5-[(benzylamino)methyl]-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;ethane
CID 143995106
N-[(4,6-dimethyl-3-pyridinyl)methyl]-1-phenylmethanamine
CID 130854459
3-[(benzylamino)methyl]-7-chloro-6-methyl-1H-quinolin-2-one
CID 18524471
5-benzyl-2,4-dioxoimidazolidine-1-carboxamide
CID 70583178
N-[(2-ethylpyrimidin-4-yl)methyl]-1-phenylmethanamine
CID 46785098
N-benzyl-2-(2-oxo-1,3-dihydroimidazo[1,2-a]benzimidazol-1-yl)acetamide
CID 135629261
N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[(2S)-2-benzyl-1,7-dimethyl-3,5-dioxo-2,4-dihydropyrido[3,4-b]pyrazin-6-yl]acetamide
CID 10004435

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).