3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide

C23H23N3O5 — CID 2803194

IUPAC3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide
SMILESCOc1cc(C(=O)Nc2ccccc2C(=O)NCc2cccnc2)cc(OC)c1OC
InChIInChI=1S/C23H23N3O5/c1-29-19-11-16(12-20(30-2)21(19)31-3)22(27)26-18-9-5-4-8-17(18)23(28)25-14-15-7-6-10-24-13-15/h4-13H,14H2,1-3H3,(H,25,28)(H,26,27)
InChIKeyWZPAZZBZOTVLOC-UHFFFAOYSA-N
MW421.45 g/mol
LogP3.29
Rot. Bonds8

About 3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide

3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide (PubChem CID 2803194) has the molecular formula C23H23N3O5 and a molecular weight of 421.45 g/mol. Its IUPAC name is 3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide.

Molecular Properties

Compound Name3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide
PubChem CID2803194
Molecular FormulaC23H23N3O5
Molecular Weight421.45 g/mol
Exact Mass421.16
IUPAC Name3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide
SMILESCOc1cc(C(=O)Nc2ccccc2C(=O)NCc2cccnc2)cc(OC)c1OC
InChIInChI=1S/C23H23N3O5/c1-29-19-11-16(12-20(30-2)21(19)31-3)22(27)26-18-9-5-4-8-17(18)23(28)25-14-15-7-6-10-24-13-15/h4-13H,14H2,1-3H3,(H,25,28)(H,26,27)
InChIKeyWZPAZZBZOTVLOC-UHFFFAOYSA-N
XLogP3.29
TPSA98.78 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.45
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide 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

4-methoxy-3-methyl-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide
CID 100500766
2-[(4-methoxybenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide
CID 991450
3,4,5-trimethoxy-N-[2-[(4-methylphenyl)methylcarbamoyl]phenyl]benzamide
CID 17320425
2-[[2-(2-methoxyphenoxy)acetyl]amino]-N-(pyridin-3-ylmethyl)benzamide
CID 6459085
3,4,5-trimethoxy-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide
CID 55708070
2-[2-(2-methoxyphenoxy)propanoylamino]-N-(pyridin-3-ylmethyl)benzamide
CID 6498921
2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide
CID 6457396
3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylamino)ethyl]benzamide
CID 4543569
3,4,5-trimethoxy-N-[2-[(2-methoxyphenyl)carbamoyl]phenyl]benzamide
CID 990875
2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide
CID 2986089
N-[2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]-3,4,5-trimethoxybenzamide
CID 4094581
2-iodo-4-methyl-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide
CID 100525900

Frequently Asked Questions

What is the IUPAC name of 3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide?
The IUPAC name of 3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide (CID 2803194) is 3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide.
What is the SMILES notation for 3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide?
The canonical SMILES for 3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide is COc1cc(C(=O)Nc2ccccc2C(=O)NCc2cccnc2)cc(OC)c1OC.
What is the InChIKey of 3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide?
The InChIKey is WZPAZZBZOTVLOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O5/c1-29-19-11-16(12-20(30-2)21(19)31-3)22(27)26-18-9-5-4-8-17(18)23(28)25-14-15-7-6-10-24-13-15/h4-13H,14H2,1-3H3,(H,25,28)(H,26,27).
What are the key properties of 3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide?
3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide has a molecular weight of 421.45 g/mol, XLogP of 3.29, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide is sourced from PubChem (CID 2803194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).