5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione

C19H18FNO3 — CID 155384863

IUPAC5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione
SMILESCC1(CCc2ccc(F)cc2)OC(=O)c2c1ccn(C1CC1)c2=O
InChIInChI=1S/C19H18FNO3/c1-19(10-8-12-2-4-13(20)5-3-12)15-9-11-21(14-6-7-14)17(22)16(15)18(23)24-19/h2-5,9,11,14H,6-8,10H2,1H3
InChIKeyBYMXJFSLZWOMCK-UHFFFAOYSA-N
MW327.36 g/mol
LogP3.34
Rot. Bonds4

About 5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione

5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione (PubChem CID 155384863) has the molecular formula C19H18FNO3 and a molecular weight of 327.36 g/mol. Its IUPAC name is 5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione.

Molecular Properties

Compound Name5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione
PubChem CID155384863
Molecular FormulaC19H18FNO3
Molecular Weight327.36 g/mol
Exact Mass327.13
IUPAC Name5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione
SMILESCC1(CCc2ccc(F)cc2)OC(=O)c2c1ccn(C1CC1)c2=O
InChIInChI=1S/C19H18FNO3/c1-19(10-8-12-2-4-13(20)5-3-12)15-9-11-21(14-6-7-14)17(22)16(15)18(23)24-19/h2-5,9,11,14H,6-8,10H2,1H3
InChIKeyBYMXJFSLZWOMCK-UHFFFAOYSA-N
XLogP3.34
TPSA48.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.36
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione with MolForge

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Related Compounds

5-Cyclopropyl-1-methyl-1-phenylfuro[3,4-c]pyridine-3,4-dione
CID 155384877
5-[3-(Diethylamino)-2-hydroxypropyl]-1-methyl-1-(2-phenylethyl)furo[3,4-c]pyridine-3,4-dione
CID 71744954
5-[2-(4-Fluorophenyl)ethyl]-1,1-dimethylfuro[3,4-c]pyridine-3,4-dione
CID 70692327
1,1-dimethyl-5-phenethyl-1H,5H-furo[3,4-c]pyridine-3,4-dione
CID 70694388
1-Methyl-5-(3-morpholin-4-ylpropyl)-1-(2-phenylethyl)furo[3,4-c]pyridine-3,4-dione
CID 71602492
1,5-Dimethyl-1-phenylfuro[3,4-c]pyridine-3,4-dione
CID 71602621
methyl 1-cyclopropyl-8-(3-fluoro-phenyl)-9-methyl-4-oxo-4H-quinolizine-3-carboxylate
CID 86696553
ethyl 1-cyclopropyl-8-(4-fluoro-phenyl)-9-methyl-4-oxo-4H-quinolizine-3-carboxylate
CID 86696578
5-Cyclopropyl-1-[3-(4-fluorophenyl)propyl]-1-methylfuro[3,4-c]pyridine-3,4-dione
CID 155384881
N-cyclopropyl-N-[(Z)-2-[2-[3-(4-fluorophenyl)propyl]-2,4-dimethyl-5-oxofuran-3-yl]ethenyl]formamide
CID 155394894
Methyl 1-cyclopropyl-8-[3-fluoro-4-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]phenyl]-9-methyl-4-oxoquinolizine-3-carboxylate
CID 159269704
Methyl 1-cyclopropyl-8-[3-fluoro-4-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]phenyl]-4-oxoquinolizine-3-carboxylate
CID 160147259

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione?
The IUPAC name of 5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione (CID 155384863) is 5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione.
What is the SMILES notation for 5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione?
The canonical SMILES for 5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione is CC1(CCc2ccc(F)cc2)OC(=O)c2c1ccn(C1CC1)c2=O.
What is the InChIKey of 5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione?
The InChIKey is BYMXJFSLZWOMCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FNO3/c1-19(10-8-12-2-4-13(20)5-3-12)15-9-11-21(14-6-7-14)17(22)16(15)18(23)24-19/h2-5,9,11,14H,6-8,10H2,1H3.
What are the key properties of 5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione?
5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione has a molecular weight of 327.36 g/mol, XLogP of 3.34, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]-1-methylfuro[3,4-c]pyridine-3,4-dione is sourced from PubChem (CID 155384863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).