2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide

C21H22N2O4 — CID 4193084

IUPAC2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide
SMILESCOCCNC(=O)c1cc(-c2ccc(OC)cc2OC)nc2ccccc12
InChIInChI=1S/C21H22N2O4/c1-25-11-10-22-21(24)17-13-19(23-18-7-5-4-6-15(17)18)16-9-8-14(26-2)12-20(16)27-3/h4-9,12-13H,10-11H2,1-3H3,(H,22,24)
InChIKeyGSGMOOPUWZTRDI-UHFFFAOYSA-N
MW366.42 g/mol
LogP3.30
Rot. Bonds7

About 2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide

2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide (PubChem CID 4193084) has the molecular formula C21H22N2O4 and a molecular weight of 366.42 g/mol. Its IUPAC name is 2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide
PubChem CID4193084
Molecular FormulaC21H22N2O4
Molecular Weight366.42 g/mol
Exact Mass366.16
IUPAC Name2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide
SMILESCOCCNC(=O)c1cc(-c2ccc(OC)cc2OC)nc2ccccc12
InChIInChI=1S/C21H22N2O4/c1-25-11-10-22-21(24)17-13-19(23-18-7-5-4-6-15(17)18)16-9-8-14(26-2)12-20(16)27-3/h4-9,12-13H,10-11H2,1-3H3,(H,22,24)
InChIKeyGSGMOOPUWZTRDI-UHFFFAOYSA-N
XLogP3.30
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(2,4-dimethoxyphenyl)-N-heptylquinoline-4-carboxamide
CID 4565614
2-(2,4-dimethoxyphenyl)-N-(2-pyridin-2-ylethyl)quinoline-4-carboxamide
CID 42749556
2-(2,4-dimethoxyphenyl)-N-[4-[[2-(2,4-dimethoxyphenyl)quinoline-4-carbonyl]amino]cyclohexyl]quinoline-4-carboxamide
CID 3575528
2-(2,4-dimethoxyphenyl)-N-(3-methylbutan-2-yl)quinoline-4-carboxamide
CID 42749560
2-(2,4-dimethoxyphenyl)-N-naphthalen-2-ylquinoline-4-carboxamide
CID 4659976
2-(4-methoxyphenyl)-N-(3-methoxypropyl)quinoline-4-carboxamide
CID 2078342
N-(4-chlorophenyl)-2-(2,4-dimethoxyphenyl)quinoline-4-carboxamide
CID 4150006
N-[2-(2-methoxyethylamino)-2-oxoethyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide
CID 24542876
methyl 4-[[2-(2,4-dimethoxyphenyl)quinoline-4-carbonyl]amino]benzoate
CID 3464523
2-(2,4-dimethoxyphenyl)-N-(3,3-diphenylpropyl)-6-methylquinoline-4-carboxamide
CID 3967008
2-(2,4-dimethoxyphenyl)-N-(3-fluorophenyl)quinoline-4-carboxamide
CID 1000946
2-(4-methoxyphenyl)-N-[4-[[2-(4-methoxyphenyl)quinoline-4-carbonyl]amino]butyl]quinoline-4-carboxamide
CID 3631336

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide?
The IUPAC name of 2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide (CID 4193084) is 2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide.
What is the SMILES notation for 2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide?
The canonical SMILES for 2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide is COCCNC(=O)c1cc(-c2ccc(OC)cc2OC)nc2ccccc12.
What is the InChIKey of 2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide?
The InChIKey is GSGMOOPUWZTRDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O4/c1-25-11-10-22-21(24)17-13-19(23-18-7-5-4-6-15(17)18)16-9-8-14(26-2)12-20(16)27-3/h4-9,12-13H,10-11H2,1-3H3,(H,22,24).
What are the key properties of 2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide?
2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide has a molecular weight of 366.42 g/mol, XLogP of 3.30, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxyphenyl)-N-(2-methoxyethyl)quinoline-4-carboxamide is sourced from PubChem (CID 4193084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).