N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide

C19H18N2O2 — CID 86874562

IUPACN-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc3ncccc3c2)cc1C
InChIInChI=1S/C19H18N2O2/c1-3-23-18-9-7-16(11-13(18)2)21-19(22)15-6-8-17-14(12-15)5-4-10-20-17/h4-12H,3H2,1-2H3,(H,21,22)
InChIKeyXQZKQFBIQFWWNE-UHFFFAOYSA-N
MW306.37 g/mol
LogP4.19
Rot. Bonds4

About N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide

N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide (PubChem CID 86874562) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide
PubChem CID86874562
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC NameN-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc3ncccc3c2)cc1C
InChIInChI=1S/C19H18N2O2/c1-3-23-18-9-7-16(11-13(18)2)21-19(22)15-6-8-17-14(12-15)5-4-10-20-17/h4-12H,3H2,1-2H3,(H,21,22)
InChIKeyXQZKQFBIQFWWNE-UHFFFAOYSA-N
XLogP4.19
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 ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-pyridin-4-ylquinoline-6-carboxamide
CID 53313330
3-fluoro-4-methoxy-N-quinolin-6-ylbenzamide
CID 78878548
N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide
CID 18422129
3-methoxy-4-prop-2-enoxy-N-quinolin-6-ylbenzamide
CID 60555760
N-[3-(2-ethoxyethoxy)phenyl]quinoline-6-carboxamide
CID 143859399
N-[3-[(2,6-dimethylphenyl)sulfamoyl]-4-methoxyphenyl]quinoline-6-carboxamide
CID 156859982
N-(4-iodophenyl)quinoline-6-carboxamide
CID 60723213
N-(4-ethoxy-3-methylphenyl)-4-methylsulfanylbenzamide
CID 86845707
N-quinolin-6-yl-2H-benzotriazole-5-carboxamide
CID 60555981
N-quinolin-6-ylbenzamide
CID 833617
ethyl 4-(quinolin-6-ylcarbamoylamino)benzoate
CID 165177435
N-(3-amino-4-bromophenyl)quinoline-6-carboxamide
CID 79754299

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide?
The IUPAC name of N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide (CID 86874562) is N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide.
What is the SMILES notation for N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide?
The canonical SMILES for N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide is CCOc1ccc(NC(=O)c2ccc3ncccc3c2)cc1C.
What is the InChIKey of N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide?
The InChIKey is XQZKQFBIQFWWNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-3-23-18-9-7-16(11-13(18)2)21-19(22)15-6-8-17-14(12-15)5-4-10-20-17/h4-12H,3H2,1-2H3,(H,21,22).
What are the key properties of N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide?
N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 4.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide is sourced from PubChem (CID 86874562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).