5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one

C15H16N4O — CID 105379816

IUPAC5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one
SMILESCCN1C(=O)N=C(N)C1c1ccc2nc(C)ccc2c1
InChIInChI=1S/C15H16N4O/c1-3-19-13(14(16)18-15(19)20)11-6-7-12-10(8-11)5-4-9(2)17-12/h4-8,13H,3H2,1-2H3,(H2,16,18,20)
InChIKeyJDBFWMANHJIMJC-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.40
Rot. Bonds2

About 5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one

5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one (PubChem CID 105379816) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one.

Molecular Properties

Compound Name5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one
PubChem CID105379816
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one
SMILESCCN1C(=O)N=C(N)C1c1ccc2nc(C)ccc2c1
InChIInChI=1S/C15H16N4O/c1-3-19-13(14(16)18-15(19)20)11-6-7-12-10(8-11)5-4-9(2)17-12/h4-8,13H,3H2,1-2H3,(H2,16,18,20)
InChIKeyJDBFWMANHJIMJC-UHFFFAOYSA-N
XLogP2.40
TPSA71.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one?
The IUPAC name of 5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one (CID 105379816) is 5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one.
What is the SMILES notation for 5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one?
The canonical SMILES for 5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one is CCN1C(=O)N=C(N)C1c1ccc2nc(C)ccc2c1.
What is the InChIKey of 5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one?
The InChIKey is JDBFWMANHJIMJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-3-19-13(14(16)18-15(19)20)11-6-7-12-10(8-11)5-4-9(2)17-12/h4-8,13H,3H2,1-2H3,(H2,16,18,20).
What are the key properties of 5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one?
5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one has a molecular weight of 268.32 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-ethyl-4-(2-methylquinolin-6-yl)-4H-imidazol-2-one is sourced from PubChem (CID 105379816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).