4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide

C22H23N3O — CID 109211014

IUPAC4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide
SMILESCN(Cc1ccccc1)c1ccnc(C(=O)NCCc2ccccc2)c1
InChIInChI=1S/C22H23N3O/c1-25(17-19-10-6-3-7-11-19)20-13-15-23-21(16-20)22(26)24-14-12-18-8-4-2-5-9-18/h2-11,13,15-16H,12,14,17H2,1H3,(H,24,26)
InChIKeyNTXSDIDXVVWLML-UHFFFAOYSA-N
MW345.45 g/mol
LogP3.69
Rot. Bonds7

About 4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide

4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide (PubChem CID 109211014) has the molecular formula C22H23N3O and a molecular weight of 345.45 g/mol. Its IUPAC name is 4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide
PubChem CID109211014
Molecular FormulaC22H23N3O
Molecular Weight345.45 g/mol
Exact Mass345.18
IUPAC Name4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide
SMILESCN(Cc1ccccc1)c1ccnc(C(=O)NCCc2ccccc2)c1
InChIInChI=1S/C22H23N3O/c1-25(17-19-10-6-3-7-11-19)20-13-15-23-21(16-20)22(26)24-14-12-18-8-4-2-5-9-18/h2-11,13,15-16H,12,14,17H2,1H3,(H,24,26)
InChIKeyNTXSDIDXVVWLML-UHFFFAOYSA-N
XLogP3.69
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[benzyl(methyl)amino]-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109205672
4-[benzyl(ethyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109212580
4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109211018
N-benzyl-4-[methyl-[[4-(methylcarbamoyl)phenyl]methyl]amino]pyridine-2-carboxamide
CID 75463659
4-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
CID 109211059
N-(1,3-benzodioxol-5-ylmethyl)-4-[benzyl(methyl)amino]pyridine-2-carboxamide
CID 109211009
4-[4-(dimethylamino)anilino]-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109213610
4-[benzyl(methyl)amino]-N-(2,4-dichlorophenyl)pyridine-2-carboxamide
CID 109211114
4-[(4-aminophenyl)methyl-methylamino]-N-ethylpyridine-2-carboxamide
CID 60877624
N-(2-phenylethyl)-4-(2-phenylethylamino)pyridine-2-carboxamide
CID 109213524
4-(N-benzylanilino)-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109205803
4-N-[4-(dimethylamino)phenyl]-2-N-(2-phenylethyl)pyridine-2,4-dicarboxamide
CID 109087819

Frequently Asked Questions

What is the IUPAC name of 4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide?
The IUPAC name of 4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide (CID 109211014) is 4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide?
The canonical SMILES for 4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide is CN(Cc1ccccc1)c1ccnc(C(=O)NCCc2ccccc2)c1.
What is the InChIKey of 4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide?
The InChIKey is NTXSDIDXVVWLML-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O/c1-25(17-19-10-6-3-7-11-19)20-13-15-23-21(16-20)22(26)24-14-12-18-8-4-2-5-9-18/h2-11,13,15-16H,12,14,17H2,1H3,(H,24,26).
What are the key properties of 4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide?
4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide has a molecular weight of 345.45 g/mol, XLogP of 3.69, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 109211014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).