6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide

C23H23N3O3 — CID 109097988

IUPAC6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide
SMILESCCN(C(=O)c1cccc(C(=O)NCc2ccccc2OC)n1)c1ccccc1
InChIInChI=1S/C23H23N3O3/c1-3-26(18-11-5-4-6-12-18)23(28)20-14-9-13-19(25-20)22(27)24-16-17-10-7-8-15-21(17)29-2/h4-15H,3,16H2,1-2H3,(H,24,27)
InChIKeyIMCPCHCEOYIWIJ-UHFFFAOYSA-N
MW389.46 g/mol
LogP3.69
Rot. Bonds7

About 6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide

6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide (PubChem CID 109097988) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is 6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide
PubChem CID109097988
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC Name6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide
SMILESCCN(C(=O)c1cccc(C(=O)NCc2ccccc2OC)n1)c1ccccc1
InChIInChI=1S/C23H23N3O3/c1-3-26(18-11-5-4-6-12-18)23(28)20-14-9-13-19(25-20)22(27)24-16-17-10-7-8-15-21(17)29-2/h4-15H,3,16H2,1-2H3,(H,24,27)
InChIKeyIMCPCHCEOYIWIJ-UHFFFAOYSA-N
XLogP3.69
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide (CID 109097988) is 6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide is CCN(C(=O)c1cccc(C(=O)NCc2ccccc2OC)n1)c1ccccc1.
What is the InChIKey of 6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide?
The InChIKey is IMCPCHCEOYIWIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c1-3-26(18-11-5-4-6-12-18)23(28)20-14-9-13-19(25-20)22(27)24-16-17-10-7-8-15-21(17)29-2/h4-15H,3,16H2,1-2H3,(H,24,27).
What are the key properties of 6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide?
6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide has a molecular weight of 389.46 g/mol, XLogP of 3.69, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide is sourced from PubChem (CID 109097988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).