2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide

C26H24N2O2 — CID 22578077

IUPAC2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide
SMILESCc1ccc(COc2cc(C(=O)NCc3ccccc3C)c3ccccc3n2)cc1
InChIInChI=1S/C26H24N2O2/c1-18-11-13-20(14-12-18)17-30-25-15-23(22-9-5-6-10-24(22)28-25)26(29)27-16-21-8-4-3-7-19(21)2/h3-15H,16-17H2,1-2H3,(H,27,29)
InChIKeyZNUOPVASHPAOHK-UHFFFAOYSA-N
MW396.49 g/mol
LogP5.36
Rot. Bonds6

About 2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide

2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide (PubChem CID 22578077) has the molecular formula C26H24N2O2 and a molecular weight of 396.49 g/mol. Its IUPAC name is 2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide.

Molecular Properties

Compound Name2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide
PubChem CID22578077
Molecular FormulaC26H24N2O2
Molecular Weight396.49 g/mol
Exact Mass396.18
IUPAC Name2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide
SMILESCc1ccc(COc2cc(C(=O)NCc3ccccc3C)c3ccccc3n2)cc1
InChIInChI=1S/C26H24N2O2/c1-18-11-13-20(14-12-18)17-30-25-15-23(22-9-5-6-10-24(22)28-25)26(29)27-16-21-8-4-3-7-19(21)2/h3-15H,16-17H2,1-2H3,(H,27,29)
InChIKeyZNUOPVASHPAOHK-UHFFFAOYSA-N
XLogP5.36
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.49
LogP ≤ 55.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-[(4-methylphenyl)methoxy]quinoline-4-carboxamide
CID 22578030
N-[2-(2-methylphenyl)ethyl]-2-[(4-methylphenyl)methoxy]quinoline-4-carboxamide
CID 22578073
N-[(2-methoxyphenyl)methyl]-2-[(4-methylphenyl)methoxy]quinoline-4-carboxamide
CID 22578050
N-[(2-ethoxyphenyl)methyl]-2-[(4-methylphenyl)methoxy]quinoline-4-carboxamide
CID 22578064
N-[(4-fluorophenyl)methyl]-2-phenylmethoxyquinoline-4-carboxamide
CID 22578001
2-phenylmethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]quinoline-4-carboxamide
CID 22578012
N-(2-phenylethyl)-2-phenylmethoxyquinoline-4-carboxamide
CID 22577997
N-[2-(4-chlorophenyl)ethyl]-2-phenylmethoxyquinoline-4-carboxamide
CID 22577984
2-methoxy-N-[(2-methoxyquinolin-4-yl)methyl]-4-methylbenzamide
CID 136533990
N-[(4-methoxyphenyl)methyl]-2-(2-methylphenyl)quinoline-4-carboxamide
CID 3269613
N-[2-[(4-methylphenyl)methylcarbamoyl]phenyl]-2-phenylquinoline-4-carboxamide
CID 17320376
2-(2-methylphenyl)-N-[[3-[[[2-(2-methylphenyl)quinoline-4-carbonyl]amino]methyl]phenyl]methyl]quinoline-4-carboxamide
CID 5107909

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide?
The IUPAC name of 2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide (CID 22578077) is 2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide.
What is the SMILES notation for 2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide?
The canonical SMILES for 2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide is Cc1ccc(COc2cc(C(=O)NCc3ccccc3C)c3ccccc3n2)cc1.
What is the InChIKey of 2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide?
The InChIKey is ZNUOPVASHPAOHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O2/c1-18-11-13-20(14-12-18)17-30-25-15-23(22-9-5-6-10-24(22)28-25)26(29)27-16-21-8-4-3-7-19(21)2/h3-15H,16-17H2,1-2H3,(H,27,29).
What are the key properties of 2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide?
2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide has a molecular weight of 396.49 g/mol, XLogP of 5.36, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methylphenyl)methoxy]-N-[(2-methylphenyl)methyl]quinoline-4-carboxamide is sourced from PubChem (CID 22578077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).