N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide

C29H24N2O4 — CID 67520391

IUPACN-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide
SMILESCOc1cc2nccc(Oc3ccc4cc(C(=O)NCc5ccccc5)ccc4c3)c2cc1OC
InChIInChI=1S/C29H24N2O4/c1-33-27-16-24-25(17-28(27)34-2)30-13-12-26(24)35-23-11-10-20-14-22(9-8-21(20)15-23)29(32)31-18-19-6-4-3-5-7-19/h3-17H,18H2,1-2H3,(H,31,32)
InChIKeyYDBWZPPEJZLDAI-UHFFFAOYSA-N
MW464.52 g/mol
LogP6.13
Rot. Bonds7

About N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide

N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide (PubChem CID 67520391) has the molecular formula C29H24N2O4 and a molecular weight of 464.52 g/mol. Its IUPAC name is N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide
PubChem CID67520391
Molecular FormulaC29H24N2O4
Molecular Weight464.52 g/mol
Exact Mass464.17
IUPAC NameN-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide
SMILESCOc1cc2nccc(Oc3ccc4cc(C(=O)NCc5ccccc5)ccc4c3)c2cc1OC
InChIInChI=1S/C29H24N2O4/c1-33-27-16-24-25(17-28(27)34-2)30-13-12-26(24)35-23-11-10-20-14-22(9-8-21(20)15-23)29(32)31-18-19-6-4-3-5-7-19/h3-17H,18H2,1-2H3,(H,31,32)
InChIKeyYDBWZPPEJZLDAI-UHFFFAOYSA-N
XLogP6.13
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.52
LogP ≤ 56.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(6-methoxy-7-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide
CID 167695764
6-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxy-N-methylnaphthalene-1-carboxamide
CID 67276786
N-[6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalen-1-yl]-2-phenylacetamide
CID 59813522
1-benzyl-3-[6-(6-hydroxy-7-methoxyquinolin-4-yl)oxynaphthalen-1-yl]urea
CID 143083833
6-(6,7-dimethoxyquinolin-4-yl)oxyquinoline-3-carboxylic acid
CID 59813662
4-(6,7-dimethoxyquinolin-4-yl)oxybenzoic acid
CID 22132796
7-(6,7-dimethoxyquinolin-4-yl)oxy-N-[4-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide
CID 11387053
7-(6,7-dimethoxyquinolin-4-yl)oxy-N-[3-(trifluoromethoxy)phenyl]naphthalene-2-carboxamide
CID 11376060
5-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-methylphenyl]-1-phenyl-4-sulfanylidenepentan-2-one
CID 58249507
N-[6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalen-1-yl]-3,4-dimethylbenzamide
CID 59813296
1-[5-(6,7-dimethoxyquinolin-4-yl)oxy-2-pyridinyl]-3-(2-phenylethyl)urea
CID 11626442
N-[6-[7-[2-(dimethylamino)ethoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-2-yl]benzamide;ethane;molecular hydrogen
CID 143083731

Frequently Asked Questions

What is the IUPAC name of N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide?
The IUPAC name of N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide (CID 67520391) is N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide.
What is the SMILES notation for N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide?
The canonical SMILES for N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide is COc1cc2nccc(Oc3ccc4cc(C(=O)NCc5ccccc5)ccc4c3)c2cc1OC.
What is the InChIKey of N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide?
The InChIKey is YDBWZPPEJZLDAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H24N2O4/c1-33-27-16-24-25(17-28(27)34-2)30-13-12-26(24)35-23-11-10-20-14-22(9-8-21(20)15-23)29(32)31-18-19-6-4-3-5-7-19/h3-17H,18H2,1-2H3,(H,31,32).
What are the key properties of N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide?
N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide has a molecular weight of 464.52 g/mol, XLogP of 6.13, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-2-carboxamide is sourced from PubChem (CID 67520391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).