2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide

C23H22N4O4 — CID 91218925

IUPAC2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide
SMILESCc1cc(COc2ccc(NC(=O)C(C)c3[nH]c(=O)[nH]c3O)cc2)c2ccccc2n1
InChIInChI=1S/C23H22N4O4/c1-13-11-15(18-5-3-4-6-19(18)24-13)12-31-17-9-7-16(8-10-17)25-21(28)14(2)20-22(29)27-23(30)26-20/h3-11,14,29H,12H2,1-2H3,(H,25,28)(H2,26,27,30)
InChIKeyYWLBZURMCCXUBJ-UHFFFAOYSA-N
MW418.45 g/mol
LogP3.59
Rot. Bonds6

About 2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide

2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide (PubChem CID 91218925) has the molecular formula C23H22N4O4 and a molecular weight of 418.45 g/mol. Its IUPAC name is 2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide.

Molecular Properties

Compound Name2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide
PubChem CID91218925
Molecular FormulaC23H22N4O4
Molecular Weight418.45 g/mol
Exact Mass418.16
IUPAC Name2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide
SMILESCc1cc(COc2ccc(NC(=O)C(C)c3[nH]c(=O)[nH]c3O)cc2)c2ccccc2n1
InChIInChI=1S/C23H22N4O4/c1-13-11-15(18-5-3-4-6-19(18)24-13)12-31-17-9-7-16(8-10-17)25-21(28)14(2)20-22(29)27-23(30)26-20/h3-11,14,29H,12H2,1-2H3,(H,25,28)(H2,26,27,30)
InChIKeyYWLBZURMCCXUBJ-UHFFFAOYSA-N
XLogP3.59
TPSA120.10 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.45
LogP ≤ 53.59
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-piperidin-4-ylmethyl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide
CID 91355488
N-[(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-(oxan-4-yl)methyl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide
CID 90727856
2-(4-hydroxy-3-methyl-2-oxo-1H-imidazol-5-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]acetamide
CID 91936088
4-[(2-methylquinolin-4-yl)methoxy]benzoic acid
CID 22032775
N-[5-anilino-5-oxo-1-(2-oxo-3H-1,3,4-thiadiazol-5-yl)pentan-2-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide
CID 143651052
4-[(2-methylquinolin-4-yl)methoxy]benzenesulfinic acid
CID 22032785
(2S,3S,5R)-5-fluoro-2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]carbamoyl]piperidine-3-carboxylic acid
CID 68649543
4-[(2-methylquinolin-4-yl)methoxy]-N-[2-(2-oxo-3H-1,3,4-thiadiazol-5-yl)-2-phenylethyl]benzamide
CID 143650504
2-(2,4-dioxo-1,3,7-triazaspiro[4.4]nonan-9-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]acetamide
CID 10115425
2-(2-methyl-4-oxoquinazolin-3-yl)-N-(4-phenylmethoxyphenyl)propanamide
CID 43022874
N,3-dihydroxy-2-[(4-methoxyphenyl)methyl]-3-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide
CID 10367542
[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine
CID 22148915

Frequently Asked Questions

What is the IUPAC name of 2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide?
The IUPAC name of 2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide (CID 91218925) is 2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide.
What is the SMILES notation for 2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide?
The canonical SMILES for 2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide is Cc1cc(COc2ccc(NC(=O)C(C)c3[nH]c(=O)[nH]c3O)cc2)c2ccccc2n1.
What is the InChIKey of 2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide?
The InChIKey is YWLBZURMCCXUBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O4/c1-13-11-15(18-5-3-4-6-19(18)24-13)12-31-17-9-7-16(8-10-17)25-21(28)14(2)20-22(29)27-23(30)26-20/h3-11,14,29H,12H2,1-2H3,(H,25,28)(H2,26,27,30).
What are the key properties of 2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide?
2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide has a molecular weight of 418.45 g/mol, XLogP of 3.59, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]propanamide is sourced from PubChem (CID 91218925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).