1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one

C19H17N3O2 — CID 135697392

IUPAC1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one
SMILESO=c1c(C2=NCCN2)c(O)c2ccccc2n1Cc1ccccc1
InChIInChI=1S/C19H17N3O2/c23-17-14-8-4-5-9-15(14)22(12-13-6-2-1-3-7-13)19(24)16(17)18-20-10-11-21-18/h1-9,23H,10-12H2,(H,20,21)
InChIKeyUCNWSCBIDDPHPD-UHFFFAOYSA-N
MW319.36 g/mol
LogP2.11
Rot. Bonds3

About 1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one

1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one (PubChem CID 135697392) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is 1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one.

Molecular Properties

Compound Name1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one
PubChem CID135697392
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC Name1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one
SMILESO=c1c(C2=NCCN2)c(O)c2ccccc2n1Cc1ccccc1
InChIInChI=1S/C19H17N3O2/c23-17-14-8-4-5-9-15(14)22(12-13-6-2-1-3-7-13)19(24)16(17)18-20-10-11-21-18/h1-9,23H,10-12H2,(H,20,21)
InChIKeyUCNWSCBIDDPHPD-UHFFFAOYSA-N
XLogP2.11
TPSA66.62 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-benzyl-3-(dimethylamino)-4-hydroxyquinolin-2-one
CID 54706810
1-benzyl-4-hydroxy-2-oxoquinoline-3-carboxylic acid
CID 54726736
1-benzyl-4-hydroxy-3-(7-methyl-1,1-dioxo-4H-pyrido[2,3-e][1,2,4]thiadiazin-3-yl)quinolin-2-one
CID 135507263
4-hydroxy-3-phenyl-1-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]quinolin-2-one
CID 54726671
1-benzyl-3-(1,1-dioxo-4H-1λ6,2,4-benzothiadiazin-3-yl)-4-hydroxy-1,7-naphthyridin-2-one
CID 135525376
ethyl 1-benzyl-4-hydroxy-2-oxoquinoline-3-carboxylate
CID 54711837
1-[(4-fluorophenyl)methyl]-4-hydroxy-2-oxoquinoline-3-carbonitrile
CID 58799228
4-hydroxy-2-oxo-1-(pyridin-3-ylmethyl)quinoline-3-carboxamide
CID 135563908
3-(1-benzyl-4-hydroxy-2-oxoquinolin-3-yl)-N-[(2S)-2,3-dihydroxypropyl]-2H-thieno[2,3-e][1,2,4]thiadiazine-7-carboxamide
CID 136648324
1-benzyl-3-(1,1-dioxo-4H-1λ6,2,4-benzothiadiazin-3-yl)-4-hydroxy-1,8-naphthyridin-2-one
CID 135517454
5,7-dibenzylindolo[2,3-b]carbazole-6,12-dione
CID 101168915
5-benzyl-10-methylphenanthridin-6-one
CID 71505961

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one?
The IUPAC name of 1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one (CID 135697392) is 1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one.
What is the SMILES notation for 1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one?
The canonical SMILES for 1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one is O=c1c(C2=NCCN2)c(O)c2ccccc2n1Cc1ccccc1.
What is the InChIKey of 1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one?
The InChIKey is UCNWSCBIDDPHPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2/c23-17-14-8-4-5-9-15(14)22(12-13-6-2-1-3-7-13)19(24)16(17)18-20-10-11-21-18/h1-9,23H,10-12H2,(H,20,21).
What are the key properties of 1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one?
1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one has a molecular weight of 319.36 g/mol, XLogP of 2.11, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxyquinolin-2-one is sourced from PubChem (CID 135697392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).