N-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide

C19H18N2O2 — CID 31098936

IUPACN-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide
SMILESCCONC(=O)c1cc(-c2ccccc2)nc2ccc(C)cc12
InChIInChI=1S/C19H18N2O2/c1-3-23-21-19(22)16-12-18(14-7-5-4-6-8-14)20-17-10-9-13(2)11-15(16)17/h4-12H,3H2,1-2H3,(H,21,22)
InChIKeyZTRLHIVWJGMBRX-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.89
Rot. Bonds4

About N-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide

N-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide (PubChem CID 31098936) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is N-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide
PubChem CID31098936
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC NameN-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide
SMILESCCONC(=O)c1cc(-c2ccccc2)nc2ccc(C)cc12
InChIInChI=1S/C19H18N2O2/c1-3-23-21-19(22)16-12-18(14-7-5-4-6-8-14)20-17-10-9-13(2)11-15(16)17/h4-12H,3H2,1-2H3,(H,21,22)
InChIKeyZTRLHIVWJGMBRX-UHFFFAOYSA-N
XLogP3.89
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxyethyl)-6-methyl-2-phenylquinoline-4-carboxamide
CID 4795719
ethyl 4,5-dimethyl-2-[(6-methyl-2-phenylquinoline-4-carbonyl)amino]thiophene-3-carboxylate
CID 3165783
6-methyl-N-(2-methylnaphthalen-1-yl)-2-phenylquinoline-4-carboxamide
CID 3165781
ethyl 6-hydroxy-2-phenylquinoline-4-carboxylate
CID 67204819
6-methyl-N-(4-methyl-2-pyridinyl)-2-phenylquinoline-4-carboxamide
CID 16573417
N-ethoxy-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 18168945
N-(3,4-dichlorophenyl)-6-methyl-2-phenylquinoline-4-carboxamide
CID 3131018
ethyl 3-[[2-(4-acetamidophenyl)-6-methylquinoline-4-carbonyl]amino]benzoate
CID 46375330
N,N-bis(2-hydroxyethyl)-6-methyl-2-phenylquinoline-4-carboxamide
CID 4522233
2-(4-ethylphenyl)-6-methylquinoline-4-carboxylic acid
CID 1225955
2-(4-methoxyphenyl)-6-methyl-N-(3-methylbutyl)quinoline-4-carboxamide
CID 42749977
6-methyl-N-(3-nitrophenyl)-2-phenylquinoline-4-carboxamide
CID 1122087

Frequently Asked Questions

What is the IUPAC name of N-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide?
The IUPAC name of N-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide (CID 31098936) is N-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide.
What is the SMILES notation for N-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide?
The canonical SMILES for N-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide is CCONC(=O)c1cc(-c2ccccc2)nc2ccc(C)cc12.
What is the InChIKey of N-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide?
The InChIKey is ZTRLHIVWJGMBRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-3-23-21-19(22)16-12-18(14-7-5-4-6-8-14)20-17-10-9-13(2)11-15(16)17/h4-12H,3H2,1-2H3,(H,21,22).
What are the key properties of N-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide?
N-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxy-6-methyl-2-phenylquinoline-4-carboxamide is sourced from PubChem (CID 31098936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).