N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide

C23H25N3O2 — CID 109156352

IUPACN-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide
SMILESCOc1cccc(CCNc2ccc(C(=O)N(C)Cc3ccccc3)cn2)c1
InChIInChI=1S/C23H25N3O2/c1-26(17-19-7-4-3-5-8-19)23(27)20-11-12-22(25-16-20)24-14-13-18-9-6-10-21(15-18)28-2/h3-12,15-16H,13-14,17H2,1-2H3,(H,24,25)
InChIKeyKDWQCMLULHGJLE-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.02
Rot. Bonds8

About N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide

N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide (PubChem CID 109156352) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide
PubChem CID109156352
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC NameN-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide
SMILESCOc1cccc(CCNc2ccc(C(=O)N(C)Cc3ccccc3)cn2)c1
InChIInChI=1S/C23H25N3O2/c1-26(17-19-7-4-3-5-8-19)23(27)20-11-12-22(25-16-20)24-14-13-18-9-6-10-21(15-18)28-2/h3-12,15-16H,13-14,17H2,1-2H3,(H,24,25)
InChIKeyKDWQCMLULHGJLE-UHFFFAOYSA-N
XLogP4.02
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-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-benzyl-6-(butylamino)-N-methylpyridine-3-carboxamide
CID 109151561
6-(benzylamino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 109155485
N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide
CID 109210893
5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine
CID 104861065
N-benzyl-6-(2-phenylethylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 109158221
N-(3-methoxyphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160801
N-methyl-6-(2-phenylethylamino)-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 109158205
N-butyl-6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide
CID 109158989
5-[2-(3-methoxyphenyl)ethylamino]pyrazine-2-carboxylic acid
CID 107853484
N-(2,5-dimethoxyphenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158252
4-fluoro-N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]benzamide
CID 113013432
6-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide
CID 1447920

Frequently Asked Questions

What is the IUPAC name of N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide?
The IUPAC name of N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide (CID 109156352) is N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide.
What is the SMILES notation for N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide?
The canonical SMILES for N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide is COc1cccc(CCNc2ccc(C(=O)N(C)Cc3ccccc3)cn2)c1.
What is the InChIKey of N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide?
The InChIKey is KDWQCMLULHGJLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-26(17-19-7-4-3-5-8-19)23(27)20-11-12-22(25-16-20)24-14-13-18-9-6-10-21(15-18)28-2/h3-12,15-16H,13-14,17H2,1-2H3,(H,24,25).
What are the key properties of N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide?
N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide has a molecular weight of 375.47 g/mol, XLogP of 4.02, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 109156352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).