7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one

C17H19N3O2 — CID 59434804

IUPAC7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one
SMILESCOc1ccc2c(=O)cc(-c3ncc(C(C)C)[nH]3)[nH]c2c1C
InChIInChI=1S/C17H19N3O2/c1-9(2)13-8-18-17(20-13)12-7-14(21)11-5-6-15(22-4)10(3)16(11)19-12/h5-9H,1-4H3,(H,18,20)(H,19,21)
InChIKeyFJQXZMPMSYZHBP-UHFFFAOYSA-N
MW297.36 g/mol
LogP3.36
Rot. Bonds3

About 7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one

7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one (PubChem CID 59434804) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is 7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one.

Molecular Properties

Compound Name7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one
PubChem CID59434804
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Name7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one
SMILESCOc1ccc2c(=O)cc(-c3ncc(C(C)C)[nH]3)[nH]c2c1C
InChIInChI=1S/C17H19N3O2/c1-9(2)13-8-18-17(20-13)12-7-14(21)11-5-6-15(22-4)10(3)16(11)19-12/h5-9H,1-4H3,(H,18,20)(H,19,21)
InChIKeyFJQXZMPMSYZHBP-UHFFFAOYSA-N
XLogP3.36
TPSA70.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one?
The IUPAC name of 7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one (CID 59434804) is 7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one.
What is the SMILES notation for 7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one?
The canonical SMILES for 7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one is COc1ccc2c(=O)cc(-c3ncc(C(C)C)[nH]3)[nH]c2c1C.
What is the InChIKey of 7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one?
The InChIKey is FJQXZMPMSYZHBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-9(2)13-8-18-17(20-13)12-7-14(21)11-5-6-15(22-4)10(3)16(11)19-12/h5-9H,1-4H3,(H,18,20)(H,19,21).
What are the key properties of 7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one?
7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one has a molecular weight of 297.36 g/mol, XLogP of 3.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-8-methyl-2-(5-propan-2-yl-1H-imidazol-2-yl)-1H-quinolin-4-one is sourced from PubChem (CID 59434804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).