6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide

C24H27N3O3 — CID 1447920

IUPAC6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide
SMILESCOc1ccc(CCNc2ccc(C(=O)NCCc3ccccc3)cn2)cc1OC
InChIInChI=1S/C24H27N3O3/c1-29-21-10-8-19(16-22(21)30-2)13-14-25-23-11-9-20(17-27-23)24(28)26-15-12-18-6-4-3-5-7-18/h3-11,16-17H,12-15H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyKINJPJUSDFQAIQ-UHFFFAOYSA-N
MW405.50 g/mol
LogP3.73
Rot. Bonds10

About 6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide

6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide (PubChem CID 1447920) has the molecular formula C24H27N3O3 and a molecular weight of 405.50 g/mol. Its IUPAC name is 6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide
PubChem CID1447920
Molecular FormulaC24H27N3O3
Molecular Weight405.50 g/mol
Exact Mass405.21
IUPAC Name6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide
SMILESCOc1ccc(CCNc2ccc(C(=O)NCCc3ccccc3)cn2)cc1OC
InChIInChI=1S/C24H27N3O3/c1-29-21-10-8-19(16-22(21)30-2)13-14-25-23-11-9-20(17-27-23)24(28)26-15-12-18-6-4-3-5-7-18/h3-11,16-17H,12-15H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyKINJPJUSDFQAIQ-UHFFFAOYSA-N
XLogP3.73
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.50
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-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

N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide
CID 109153751
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-(2-methylpropylamino)pyridine-3-carboxamide
CID 109151811
6-[2-(4-chlorophenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109158292
6-(2-phenylethylamino)-N-propylpyridine-3-carboxamide
CID 109151243
N-(2-methoxyphenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158244
N-(2,5-dimethoxyphenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158252
6-(2-methoxy-5-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109158318
6-(benzylamino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 109155485
N-[3-(dimethylamino)propyl]-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109154394
6-(pentylamino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109158304
6-[2-(3-chlorophenyl)ethylamino]-N-[(2-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 109157157
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(phenoxymethyl)benzamide
CID 26733446

Frequently Asked Questions

What is the IUPAC name of 6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide?
The IUPAC name of 6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide (CID 1447920) is 6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide is COc1ccc(CCNc2ccc(C(=O)NCCc3ccccc3)cn2)cc1OC.
What is the InChIKey of 6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide?
The InChIKey is KINJPJUSDFQAIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O3/c1-29-21-10-8-19(16-22(21)30-2)13-14-25-23-11-9-20(17-27-23)24(28)26-15-12-18-6-4-3-5-7-18/h3-11,16-17H,12-15H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of 6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide?
6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide has a molecular weight of 405.50 g/mol, XLogP of 3.73, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 1447920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).