N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide

C20H17FN2O4 — CID 4288481

IUPACN-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide
SMILESCOc1ccc2c3c(c(=O)oc2c1)CN(C(=O)Nc1cccc(F)c1)CC3
InChIInChI=1S/C20H17FN2O4/c1-26-14-5-6-16-15-7-8-23(11-17(15)19(24)27-18(16)10-14)20(25)22-13-4-2-3-12(21)9-13/h2-6,9-10H,7-8,11H2,1H3,(H,22,25)
InChIKeyOJONWZQCCNMAGW-UHFFFAOYSA-N
MW368.36 g/mol
LogP3.53
Rot. Bonds2

About N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide

N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide (PubChem CID 4288481) has the molecular formula C20H17FN2O4 and a molecular weight of 368.36 g/mol. Its IUPAC name is N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide
PubChem CID4288481
Molecular FormulaC20H17FN2O4
Molecular Weight368.36 g/mol
Exact Mass368.12
IUPAC NameN-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide
SMILESCOc1ccc2c3c(c(=O)oc2c1)CN(C(=O)Nc1cccc(F)c1)CC3
InChIInChI=1S/C20H17FN2O4/c1-26-14-5-6-16-15-7-8-23(11-17(15)19(24)27-18(16)10-14)20(25)22-13-4-2-3-12(21)9-13/h2-6,9-10H,7-8,11H2,1H3,(H,22,25)
InChIKeyOJONWZQCCNMAGW-UHFFFAOYSA-N
XLogP3.53
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.36
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}

Analyze N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide 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

N-(3-fluorophenyl)pyrrolidine-1-carboxamide
CID 6469622
N-(3-fluorophenyl)-1-(4-fluorophenyl)-6-methoxy-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxamide
CID 50744377
N-(3-fluorophenyl)-4,4-dimethylpiperazin-4-ium-1-carboxamide
CID 68939615
N-(3-fluorophenyl)-3-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide
CID 3226032
N-(3-fluorophenyl)-4-sulfamoylpiperazine-1-carboxamide
CID 61131305
2-(4-fluorophenyl)-N-(3-methoxyphenyl)morpholine-4-carboxamide
CID 84524231
N-(3-methoxyphenyl)-4-sulfamoylpiperazine-1-carboxamide
CID 61321561
methyl 1-[(3-fluorophenyl)carbamoyl]piperidine-3-carboxylate
CID 78924438
(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)-(6-methoxy-3-methyl-1-benzofuran-2-yl)methanone
CID 70724076
(3S)-N-(3-fluorophenyl)-3-(methylamino)pyrrolidine-1-carboxamide
CID 172646365
(3S)-N-(3-fluorophenyl)-3-[3-[(4-methoxyphenyl)methylamino]-3-oxopropyl]piperidine-1-carboxamide
CID 95094017
N-(3-methoxyphenyl)-4-methyl-4-(methylamino)piperidine-1-carboxamide
CID 115304682

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide (CID 4288481) is N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide is COc1ccc2c3c(c(=O)oc2c1)CN(C(=O)Nc1cccc(F)c1)CC3.
What is the InChIKey of N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide?
The InChIKey is OJONWZQCCNMAGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O4/c1-26-14-5-6-16-15-7-8-23(11-17(15)19(24)27-18(16)10-14)20(25)22-13-4-2-3-12(21)9-13/h2-6,9-10H,7-8,11H2,1H3,(H,22,25).
What are the key properties of N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide?
N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide has a molecular weight of 368.36 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-8-methoxy-5-oxo-2,4-dihydro-1H-chromeno[3,4-c]pyridine-3-carboxamide is sourced from PubChem (CID 4288481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).