N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide

C19H20N2O2 — CID 110858019

IUPACN-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C19H20N2O2/c1-3-13-6-4-5-12(2)18(13)21-19(23)15-7-9-16-14(11-15)8-10-17(22)20-16/h4-7,9,11H,3,8,10H2,1-2H3,(H,20,22)(H,21,23)
InChIKeySBOCUJPTMAHYFT-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.69
Rot. Bonds3

About N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide

N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide (PubChem CID 110858019) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
PubChem CID110858019
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C19H20N2O2/c1-3-13-6-4-5-12(2)18(13)21-19(23)15-7-9-16-14(11-15)8-10-17(22)20-16/h4-7,9,11H,3,8,10H2,1-2H3,(H,20,22)(H,21,23)
InChIKeySBOCUJPTMAHYFT-UHFFFAOYSA-N
XLogP3.69
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethyl-6-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43325541
N-(2-ethyl-6-methylphenyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide
CID 17417944
N-[2-(ethylaminomethyl)phenyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide;hydrochloride
CID 119439408
N-(2-ethyl-6-methylphenyl)-3,4-dihydroxybenzamide
CID 113199272
N-(2-ethyl-6-methylphenyl)-3-sulfanylbenzamide
CID 107019745
N-(2-ethyl-6-methylphenyl)-1H-indole-6-carboxamide
CID 60773719
N-(3-chloro-4-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 17421453
N-(2-ethyl-6-methylphenyl)-1H-indazole-5-carboxamide
CID 110485449
N-(2-ethyl-6-methylphenyl)-4-sulfanylbenzamide
CID 107019746
4-tert-butyl-N-(2-ethyl-6-methylphenyl)benzamide
CID 1226062
3-bromo-N-(2-ethyl-6-methylphenyl)-4-methylbenzamide
CID 4936095
N-(2-ethyl-6-methylphenyl)-3-iodo-4-methylbenzamide
CID 4936097

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide (CID 110858019) is N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide is CCc1cccc(C)c1NC(=O)c1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
The InChIKey is SBOCUJPTMAHYFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-3-13-6-4-5-12(2)18(13)21-19(23)15-7-9-16-14(11-15)8-10-17(22)20-16/h4-7,9,11H,3,8,10H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide has a molecular weight of 308.38 g/mol, XLogP of 3.69, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide is sourced from PubChem (CID 110858019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).