2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide

C24H19FN2O3 — CID 1000946

IUPAC2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide
SMILESCOc1ccc(-c2cc(C(=O)Nc3cccc(F)c3)c3ccccc3n2)c(OC)c1
InChIInChI=1S/C24H19FN2O3/c1-29-17-10-11-19(23(13-17)30-2)22-14-20(18-8-3-4-9-21(18)27-22)24(28)26-16-7-5-6-15(25)12-16/h3-14H,1-2H3,(H,26,28)
InChIKeySRLFAAOGGPAYNS-UHFFFAOYSA-N
MW402.43 g/mol
LogP5.31
Rot. Bonds5

About 2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide

2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide (PubChem CID 1000946) has the molecular formula C24H19FN2O3 and a molecular weight of 402.43 g/mol. Its IUPAC name is 2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide
PubChem CID1000946
Molecular FormulaC24H19FN2O3
Molecular Weight402.43 g/mol
Exact Mass402.14
IUPAC Name2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide
SMILESCOc1ccc(-c2cc(C(=O)Nc3cccc(F)c3)c3ccccc3n2)c(OC)c1
InChIInChI=1S/C24H19FN2O3/c1-29-17-10-11-19(23(13-17)30-2)22-14-20(18-8-3-4-9-21(18)27-22)24(28)26-16-7-5-6-15(25)12-16/h3-14H,1-2H3,(H,26,28)
InChIKeySRLFAAOGGPAYNS-UHFFFAOYSA-N
XLogP5.31
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.43
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,4-dimethoxyphenyl)-N-naphthalen-2-ylquinoline-4-carboxamide
CID 4659976
N-(4-chlorophenyl)-2-(2,4-dimethoxyphenyl)quinoline-4-carboxamide
CID 4150006
methyl 4-[[2-(2,4-dimethoxyphenyl)quinoline-4-carbonyl]amino]benzoate
CID 3464523
2-(2,4-dimethoxyphenyl)-N-(4-sulfamoylphenyl)quinoline-4-carboxamide
CID 1010247
2-(2,5-dimethoxyphenyl)-N-pyridin-4-ylquinoline-4-carboxamide
CID 1225611
2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide
CID 4193084
2-(2,4-dimethoxyphenyl)-N-(3-methylbutan-2-yl)quinoline-4-carboxamide
CID 42749560
2-(2,4-dimethoxyphenyl)-N-[4-[[2-(2,4-dimethoxyphenyl)quinoline-4-carbonyl]amino]cyclohexyl]quinoline-4-carboxamide
CID 3575528
2-(2,5-dimethoxyphenyl)-N-(5-fluoro-2-methylphenyl)quinoline-4-carboxamide
CID 3504792
N-(2,4-dimethoxyphenyl)-2-naphthalen-1-ylquinoline-4-carboxamide
CID 2353292
N-(3-fluorophenyl)-3-methoxynaphthalene-2-carboxamide
CID 802408
N-(2,4-dimethoxyphenyl)-2-(2-propan-2-yloxyphenyl)quinoline-4-carboxamide
CID 997833

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide?
The IUPAC name of 2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide (CID 1000946) is 2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide.
What is the SMILES notation for 2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide?
The canonical SMILES for 2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide is COc1ccc(-c2cc(C(=O)Nc3cccc(F)c3)c3ccccc3n2)c(OC)c1.
What is the InChIKey of 2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide?
The InChIKey is SRLFAAOGGPAYNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19FN2O3/c1-29-17-10-11-19(23(13-17)30-2)22-14-20(18-8-3-4-9-21(18)27-22)24(28)26-16-7-5-6-15(25)12-16/h3-14H,1-2H3,(H,26,28).
What are the key properties of 2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide?
2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide has a molecular weight of 402.43 g/mol, XLogP of 5.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide is sourced from PubChem (CID 1000946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).