N-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide

C23H25N3O — CID 109189121

IUPACN-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1ccc(NCCCc2ccccc2)cn1
InChIInChI=1S/C23H25N3O/c1-26(18-20-11-6-3-7-12-20)23(27)22-15-14-21(17-25-22)24-16-8-13-19-9-4-2-5-10-19/h2-7,9-12,14-15,17,24H,8,13,16,18H2,1H3
InChIKeyFOYPILOWYRTMND-UHFFFAOYSA-N
MW359.47 g/mol
LogP4.40
Rot. Bonds8

About N-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide

N-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide (PubChem CID 109189121) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is N-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide
PubChem CID109189121
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC NameN-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1ccc(NCCCc2ccccc2)cn1
InChIInChI=1S/C23H25N3O/c1-26(18-20-11-6-3-7-12-20)23(27)22-15-14-21(17-25-22)24-16-8-13-19-9-4-2-5-10-19/h2-7,9-12,14-15,17,24H,8,13,16,18H2,1H3
InChIKeyFOYPILOWYRTMND-UHFFFAOYSA-N
XLogP4.40
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-benzyl-5-[2-(dimethylamino)ethylamino]-N-methylpyridine-2-carboxamide
CID 109185471
N-benzyl-5-(tert-butylamino)-N-methylpyridine-2-carboxamide
CID 109189123
N-(4-acetamidophenyl)-5-(3-phenylpropylamino)pyridine-2-carboxamide
CID 109194935
5-(pentylamino)-N-(3-phenylpropyl)pyridine-2-carboxamide
CID 109194843
5-[3-(dimethylamino)propylamino]-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109186106
N-[2-(4-fluorophenyl)ethyl]-5-(3-phenylpropylamino)pyridine-2-carboxamide
CID 109192324
6-[benzyl(methyl)carbamoyl]pyridine-3-carboxylic acid
CID 43427191
5-(2-methoxyethylamino)-N-(3-phenylpropyl)pyridine-2-carboxamide
CID 109184071
N-benzyl-5-(2,3-dimethylanilino)-N-methylpyridine-2-carboxamide
CID 109189147
5-[3-(dimethylamino)propylamino]-N-methyl-N-(2-pyridin-4-ylethyl)pyridine-2-carboxamide
CID 109186113
N-benzyl-5-(2,4-dichloroanilino)-N-methylpyridine-2-carboxamide
CID 109189200
N-benzyl-N-ethyl-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide
CID 109190707

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide?
The IUPAC name of N-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide (CID 109189121) is N-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide?
The canonical SMILES for N-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide is CN(Cc1ccccc1)C(=O)c1ccc(NCCCc2ccccc2)cn1.
What is the InChIKey of N-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide?
The InChIKey is FOYPILOWYRTMND-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c1-26(18-20-11-6-3-7-12-20)23(27)22-15-14-21(17-25-22)24-16-8-13-19-9-4-2-5-10-19/h2-7,9-12,14-15,17,24H,8,13,16,18H2,1H3.
What are the key properties of N-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide?
N-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide has a molecular weight of 359.47 g/mol, XLogP of 4.40, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-5-(3-phenylpropylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109189121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).