4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide

C20H18BrNO4 — CID 2235743

IUPAC4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3ccccc3c(Br)c2OC)c(OC)c1
InChIInChI=1S/C20H18BrNO4/c1-24-13-8-9-16(17(11-13)25-2)22-20(23)15-10-12-6-4-5-7-14(12)18(21)19(15)26-3/h4-11H,1-3H3,(H,22,23)
InChIKeyHDQPLRQXLKPTEG-UHFFFAOYSA-N
MW416.27 g/mol
LogP4.88
Rot. Bonds5

About 4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide

4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide (PubChem CID 2235743) has the molecular formula C20H18BrNO4 and a molecular weight of 416.27 g/mol. Its IUPAC name is 4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide.

Molecular Properties

Compound Name4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide
PubChem CID2235743
Molecular FormulaC20H18BrNO4
Molecular Weight416.27 g/mol
Exact Mass415.04
IUPAC Name4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3ccccc3c(Br)c2OC)c(OC)c1
InChIInChI=1S/C20H18BrNO4/c1-24-13-8-9-16(17(11-13)25-2)22-20(23)15-10-12-6-4-5-7-14(12)18(21)19(15)26-3/h4-11H,1-3H3,(H,22,23)
InChIKeyHDQPLRQXLKPTEG-UHFFFAOYSA-N
XLogP4.88
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.27
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-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-[(4-bromo-3-methoxynaphthalene-2-carbonyl)amino]-4-methoxybenzoic acid
CID 28668842
N-[4-[(4-bromo-3-methoxynaphthalene-2-carbonyl)amino]-2-methoxyphenyl]furan-2-carboxamide
CID 17117544
4-bromo-N-(4-iodo-2-methylphenyl)-3-methoxynaphthalene-2-carboxamide
CID 17117485
4-bromo-3-methoxy-N-(2,4,5-trichlorophenyl)naphthalene-2-carboxamide
CID 17111249
4-bromo-N-[(2-hydroxy-5-methoxyphenyl)carbamothioyl]-3-methoxynaphthalene-2-carboxamide
CID 17104219
2-amino-N-(2,4-dimethoxyphenyl)benzamide
CID 902679
2-bromo-N-(2,4-dimethoxyphenyl)-3-methylbenzamide
CID 103852740
2-chloro-N-(2,4-dimethoxyphenyl)benzamide
CID 722324
4-bromo-N-[4-chloro-2-[(R)-hydroxy(phenyl)methyl]phenyl]-3-methoxynaphthalene-2-carboxamide
CID 95733480
4-bromo-N-[4-chloro-2-[hydroxy(phenyl)methyl]phenyl]-3-methoxynaphthalene-2-carboxamide
CID 50882559
N-(2,4-dimethoxyphenyl)-1-oxoisochromene-3-carboxamide
CID 99797944
N-(2,4-dimethoxyphenyl)-2-naphthalen-1-ylquinoline-4-carboxamide
CID 2353292

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide?
The IUPAC name of 4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide (CID 2235743) is 4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide.
What is the SMILES notation for 4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide?
The canonical SMILES for 4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide is COc1ccc(NC(=O)c2cc3ccccc3c(Br)c2OC)c(OC)c1.
What is the InChIKey of 4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide?
The InChIKey is HDQPLRQXLKPTEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18BrNO4/c1-24-13-8-9-16(17(11-13)25-2)22-20(23)15-10-12-6-4-5-7-14(12)18(21)19(15)26-3/h4-11H,1-3H3,(H,22,23).
What are the key properties of 4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide?
4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide has a molecular weight of 416.27 g/mol, XLogP of 4.88, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(2,4-dimethoxyphenyl)-3-methoxynaphthalene-2-carboxamide is sourced from PubChem (CID 2235743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).