N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide

C23H20N2O2 — CID 1222302

IUPACN-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
SMILESCc1cc(C)cc(NC(=O)c2cc(-c3ccc(C)o3)nc3ccccc23)c1
InChIInChI=1S/C23H20N2O2/c1-14-10-15(2)12-17(11-14)24-23(26)19-13-21(22-9-8-16(3)27-22)25-20-7-5-4-6-18(19)20/h4-13H,1-3H3,(H,24,26)
InChIKeyGJYUAYFPEYKUPE-UHFFFAOYSA-N
MW356.43 g/mol
LogP5.67
Rot. Bonds3

About N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide

N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide (PubChem CID 1222302) has the molecular formula C23H20N2O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
PubChem CID1222302
Molecular FormulaC23H20N2O2
Molecular Weight356.43 g/mol
Exact Mass356.15
IUPAC NameN-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
SMILESCc1cc(C)cc(NC(=O)c2cc(-c3ccc(C)o3)nc3ccccc23)c1
InChIInChI=1S/C23H20N2O2/c1-14-10-15(2)12-17(11-14)24-23(26)19-13-21(22-9-8-16(3)27-22)25-20-7-5-4-6-18(19)20/h4-13H,1-3H3,(H,24,26)
InChIKeyGJYUAYFPEYKUPE-UHFFFAOYSA-N
XLogP5.67
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.43
LogP ≤ 55.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-(2-chlorophenyl)furan-2-yl]-N-(3,5-dimethylphenyl)quinoline-4-carboxamide
CID 18871528
N-[4-(diethylamino)phenyl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 3408470
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 1000925
methyl 2-[[2-(5-methylfuran-2-yl)quinoline-4-carbonyl]amino]benzoate
CID 1221258
2-(5-methylfuran-2-yl)-N-[7-[[2-(5-methylfuran-2-yl)quinoline-4-carbonyl]amino]heptyl]quinoline-4-carboxamide
CID 4639931
2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 913140
2-(5-methylfuran-2-yl)-N-[(1S)-1-phenylethyl]quinoline-4-carboxamide
CID 1221741
N-ethoxy-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 18168945
2-(5-methylfuran-2-yl)-N-(2-methylpropyl)quinoline-4-carboxamide
CID 3421567
N-[(1R)-1-cyclopropylethyl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 9266940
dimethyl 2-[[2-(5-methylfuran-2-yl)quinoline-4-carbonyl]amino]benzene-1,4-dicarboxylate
CID 1222132
2-(5-methylfuran-2-yl)-N-prop-2-enylquinoline-4-carboxamide
CID 3420064

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide?
The IUPAC name of N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide (CID 1222302) is N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide is Cc1cc(C)cc(NC(=O)c2cc(-c3ccc(C)o3)nc3ccccc23)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide?
The InChIKey is GJYUAYFPEYKUPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O2/c1-14-10-15(2)12-17(11-14)24-23(26)19-13-21(22-9-8-16(3)27-22)25-20-7-5-4-6-18(19)20/h4-13H,1-3H3,(H,24,26).
What are the key properties of N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide?
N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide has a molecular weight of 356.43 g/mol, XLogP of 5.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide is sourced from PubChem (CID 1222302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).