2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide

C22H23N3O2 — CID 109171593

IUPAC2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide
SMILESCCN(Cc1ccccc1)c1cc(C(=O)Nc2cccc(OC)c2)ccn1
InChIInChI=1S/C22H23N3O2/c1-3-25(16-17-8-5-4-6-9-17)21-14-18(12-13-23-21)22(26)24-19-10-7-11-20(15-19)27-2/h4-15H,3,16H2,1-2H3,(H,24,26)
InChIKeyRVBAUYCOSCYWRT-UHFFFAOYSA-N
MW361.45 g/mol
LogP4.37
Rot. Bonds7

About 2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide

2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide (PubChem CID 109171593) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is 2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide
PubChem CID109171593
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC Name2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide
SMILESCCN(Cc1ccccc1)c1cc(C(=O)Nc2cccc(OC)c2)ccn1
InChIInChI=1S/C22H23N3O2/c1-3-25(16-17-8-5-4-6-9-17)21-14-18(12-13-23-21)22(26)24-19-10-7-11-20(15-19)27-2/h4-15H,3,16H2,1-2H3,(H,24,26)
InChIKeyRVBAUYCOSCYWRT-UHFFFAOYSA-N
XLogP4.37
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-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

5-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyrazine-2-carboxamide
CID 109282890
2-[benzyl(ethyl)amino]-N-(4-chlorophenyl)pyridine-4-carboxamide
CID 109171588
2-[benzyl(ethyl)amino]-N-(3-chloro-4-fluorophenyl)pyridine-4-carboxamide
CID 109171589
N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide
CID 113012586
2-[benzyl(ethyl)amino]-N-quinolin-8-ylpyridine-4-carboxamide
CID 109171613
3-methoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 135564193
2-(diethylamino)-N-(3-methoxyphenyl)pyrimidine-4-carboxamide
CID 109310751
2-[benzyl(ethyl)amino]-N-(3-methylbutyl)pyridine-4-carboxamide
CID 109171578
6-[ethyl-[(4-methoxyphenyl)methyl]amino]-N-phenylpyridazine-3-carboxamide
CID 133384179
2-(4-ethoxyanilino)-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 109177953
2-[benzyl(methyl)amino]-N-(2,5-dimethoxyphenyl)pyridine-4-carboxamide
CID 109170343
2-N-(3-methoxyphenyl)-4-N-(3-phenylpropyl)pyridine-2,4-dicarboxamide
CID 109089049

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide (CID 109171593) is 2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide is CCN(Cc1ccccc1)c1cc(C(=O)Nc2cccc(OC)c2)ccn1.
What is the InChIKey of 2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide?
The InChIKey is RVBAUYCOSCYWRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-3-25(16-17-8-5-4-6-9-17)21-14-18(12-13-23-21)22(26)24-19-10-7-11-20(15-19)27-2/h4-15H,3,16H2,1-2H3,(H,24,26).
What are the key properties of 2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide?
2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide has a molecular weight of 361.45 g/mol, XLogP of 4.37, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109171593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).