(9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate

C20H17NO4 — CID 10759224

IUPAC(9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate
SMILESCC(=O)OC1Cc2c(n(Cc3ccccc3)c3ccccc3c2=O)O1
InChIInChI=1S/C20H17NO4/c1-13(22)24-18-11-16-19(23)15-9-5-6-10-17(15)21(20(16)25-18)12-14-7-3-2-4-8-14/h2-10,18H,11-12H2,1H3
InChIKeyVLEONYCKPSDMRX-UHFFFAOYSA-N
MW335.36 g/mol
LogP2.87
Rot. Bonds3

About (9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate

(9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate (PubChem CID 10759224) has the molecular formula C20H17NO4 and a molecular weight of 335.36 g/mol. Its IUPAC name is (9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate.

Molecular Properties

Compound Name(9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate
PubChem CID10759224
Molecular FormulaC20H17NO4
Molecular Weight335.36 g/mol
Exact Mass335.12
IUPAC Name(9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate
SMILESCC(=O)OC1Cc2c(n(Cc3ccccc3)c3ccccc3c2=O)O1
InChIInChI=1S/C20H17NO4/c1-13(22)24-18-11-16-19(23)15-9-5-6-10-17(15)21(20(16)25-18)12-14-7-3-2-4-8-14/h2-10,18H,11-12H2,1H3
InChIKeyVLEONYCKPSDMRX-UHFFFAOYSA-N
XLogP2.87
TPSA57.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.36
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(9-benzyl-1,2,3,4-tetrahydrocarbazol-1-yl) acetate
CID 67866847
[6-benzyl-2,2-dimethyl-5-oxo-4-(2-oxopyrrolidin-1-yl)-3,4-dihydropyrano[3,2-c]quinolin-3-yl] acetate
CID 19983163
[(2R,3R,4R)-2,4-diacetyloxy-1-benzyl-5-oxopyrrolidin-3-yl] acetate
CID 24827233
[(2S,3S)-2-acetyloxy-1-benzyl-5-oxopyrrolidin-3-yl] acetate
CID 10637302
1-(5-benzylindolo[3,2-b]indol-10-yl)ethanone
CID 563323
10-benzyl-3-methoxyacridin-9-one
CID 12751573
2,4-dibenzyl-1H-pyrrolo[3,4-b]indol-3-one
CID 134117126
1-benzyl-3,1-benzoxazine-2,4-dione
CID 520756
2-(9-benzyl-4-oxo-2,3-dihydro-1H-carbazol-2-yl)acetic acid
CID 54144840
methyl 2-(3-benzyl-2,4-dioxoquinazolin-1-yl)acetate
CID 154831058
diethyl 2-(9-benzyl-1,2,3,4-tetrahydrocarbazol-2-yl)propanedioate
CID 54473969
[(4R,4aS,5S)-1-benzyl-2-oxo-4-phenyl-4,4a,5,6-tetrahydrocyclopenta[d][1,3]oxazin-5-yl] acetate
CID 102282008

Frequently Asked Questions

What is the IUPAC name of (9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate?
The IUPAC name of (9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate (CID 10759224) is (9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate.
What is the SMILES notation for (9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate?
The canonical SMILES for (9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate is CC(=O)OC1Cc2c(n(Cc3ccccc3)c3ccccc3c2=O)O1.
What is the InChIKey of (9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate?
The InChIKey is VLEONYCKPSDMRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO4/c1-13(22)24-18-11-16-19(23)15-9-5-6-10-17(15)21(20(16)25-18)12-14-7-3-2-4-8-14/h2-10,18H,11-12H2,1H3.
What are the key properties of (9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate?
(9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate has a molecular weight of 335.36 g/mol, XLogP of 2.87, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (9-benzyl-4-oxo-2,3-dihydrofuro[2,3-b]quinolin-2-yl) acetate is sourced from PubChem (CID 10759224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).