1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione

C21H24N2O4 — CID 71602491

IUPAC1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione
SMILESCC1(c2ccccc2)OC(=O)c2c1ccn(CCCN1CCOCC1)c2=O
InChIInChI=1S/C21H24N2O4/c1-21(16-6-3-2-4-7-16)17-8-11-23(19(24)18(17)20(25)27-21)10-5-9-22-12-14-26-15-13-22/h2-4,6-8,11H,5,9-10,12-15H2,1H3
InChIKeyPZEXPPBWGXWSEG-UHFFFAOYSA-N
MW368.43 g/mol
LogP2.00
Rot. Bonds5

About 1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione

1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione (PubChem CID 71602491) has the molecular formula C21H24N2O4 and a molecular weight of 368.43 g/mol. Its IUPAC name is 1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione.

Molecular Properties

Compound Name1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione
PubChem CID71602491
Molecular FormulaC21H24N2O4
Molecular Weight368.43 g/mol
Exact Mass368.17
IUPAC Name1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione
SMILESCC1(c2ccccc2)OC(=O)c2c1ccn(CCCN1CCOCC1)c2=O
InChIInChI=1S/C21H24N2O4/c1-21(16-6-3-2-4-7-16)17-8-11-23(19(24)18(17)20(25)27-21)10-5-9-22-12-14-26-15-13-22/h2-4,6-8,11H,5,9-10,12-15H2,1H3
InChIKeyPZEXPPBWGXWSEG-UHFFFAOYSA-N
XLogP2.00
TPSA60.77 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.43
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[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-(2-hydroxy-2-phenylethyl)-1,1-dimethyl-1H,5H-furo[3,4-c]pyridine-3,4-dione
CID 70688141
5-[3-(Diethylamino)-2-hydroxypropyl]-1-methyl-1-phenylfuro[3,4-c]pyridine-3,4-dione
CID 71602427
5-(2-Hydroxy-2-phenylethyl)-1-methyl-1-(2-methylpropyl)furo[3,4-c]pyridine-3,4-dione
CID 71602429
5-[3-(Diethylamino)-2-hydroxypropyl]-1-methyl-1-(2-phenylethyl)furo[3,4-c]pyridine-3,4-dione
CID 71744954
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
5'-(2-Hydroxy-2-phenylethyl)spiro[cyclohexane-1,1'-furo[3,4-c]pyridine]-3',4'-dione
CID 73347303
3-Ethoxycarbonyl-5-methyl-7a-phenyl-6,7-dihydrofuro[3,2-c]pyridine-2(7ah),4(5h)-dione
CID 11358958
5-fluoro-3-(2-methyl-2-phenylmorpholine-4-carbonyl)-1H-pyridin-2-one
CID 131962141
Methyl 3-[4-(2-benzhydryloxyethyl)piperazin-1-yl]-3-oxopropanoate
CID 132463413
5-O-benzyl 1-O-tert-butyl 6-oxo-2,3-dihydropyridine-1,5-dicarboxylate
CID 12087749

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione?
The IUPAC name of 1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione (CID 71602491) is 1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione.
What is the SMILES notation for 1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione?
The canonical SMILES for 1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione is CC1(c2ccccc2)OC(=O)c2c1ccn(CCCN1CCOCC1)c2=O.
What is the InChIKey of 1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione?
The InChIKey is PZEXPPBWGXWSEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O4/c1-21(16-6-3-2-4-7-16)17-8-11-23(19(24)18(17)20(25)27-21)10-5-9-22-12-14-26-15-13-22/h2-4,6-8,11H,5,9-10,12-15H2,1H3.
What are the key properties of 1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione?
1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione has a molecular weight of 368.43 g/mol, XLogP of 2.00, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-(3-morpholin-4-ylpropyl)-1-phenylfuro[3,4-c]pyridine-3,4-dione is sourced from PubChem (CID 71602491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).