5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide

C23H26N4O — CID 109192949

IUPAC5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide
SMILESCN(CCc1ccncc1)c1ccc(C(=O)NCCCc2ccccc2)nc1
InChIInChI=1S/C23H26N4O/c1-27(17-13-20-11-15-24-16-12-20)21-9-10-22(26-18-21)23(28)25-14-5-8-19-6-3-2-4-7-19/h2-4,6-7,9-12,15-16,18H,5,8,13-14,17H2,1H3,(H,25,28)
InChIKeyNYNHPMOFCBSMLY-UHFFFAOYSA-N
MW374.49 g/mol
LogP3.52
Rot. Bonds9

About 5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide

5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide (PubChem CID 109192949) has the molecular formula C23H26N4O and a molecular weight of 374.49 g/mol. Its IUPAC name is 5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide
PubChem CID109192949
Molecular FormulaC23H26N4O
Molecular Weight374.49 g/mol
Exact Mass374.21
IUPAC Name5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide
SMILESCN(CCc1ccncc1)c1ccc(C(=O)NCCCc2ccccc2)nc1
InChIInChI=1S/C23H26N4O/c1-27(17-13-20-11-15-24-16-12-20)21-9-10-22(26-18-21)23(28)25-14-5-8-19-6-3-2-4-7-19/h2-4,6-7,9-12,15-16,18H,5,8,13-14,17H2,1H3,(H,25,28)
InChIKeyNYNHPMOFCBSMLY-UHFFFAOYSA-N
XLogP3.52
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-methoxyphenyl)ethyl]-5-[methyl(2-pyridin-4-ylethyl)amino]pyridine-2-carboxamide
CID 109192474
5-(N-ethylanilino)-N-(3-phenylpropyl)pyridine-2-carboxamide
CID 109194856
N-tert-butyl-5-[methyl(2-pyridin-4-ylethyl)amino]pyridine-2-carboxamide
CID 109192950
5-[methyl(2-pyridin-4-ylethyl)amino]-N,N-dipropylpyridine-2-carboxamide
CID 109192958
2-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-4-carboxamide
CID 109173170
N-(3,5-dimethylphenyl)-5-[methyl(2-pyridin-4-ylethyl)amino]pyridine-2-carboxamide
CID 109192971
5-[methyl(2-pyridin-4-ylethyl)amino]pyridine-2-carbothioamide
CID 115488282
N-(2,4-dimethylphenyl)-5-[methyl(2-pyridin-4-ylethyl)amino]pyridine-2-carboxamide
CID 109192968
5-[butyl(methyl)amino]-N-pentylpyridine-2-carboxamide
CID 109195719
5-amino-N-(3-phenylpropyl)pyridine-2-carboxamide
CID 81316646
5-[butyl(methyl)amino]-N-[3-(dimethylamino)propyl]pyridine-2-carboxamide
CID 109185972
6-[methyl(2-pyridin-4-ylethyl)amino]-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109158287

Frequently Asked Questions

What is the IUPAC name of 5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide?
The IUPAC name of 5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide (CID 109192949) is 5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide is CN(CCc1ccncc1)c1ccc(C(=O)NCCCc2ccccc2)nc1.
What is the InChIKey of 5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide?
The InChIKey is NYNHPMOFCBSMLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O/c1-27(17-13-20-11-15-24-16-12-20)21-9-10-22(26-18-21)23(28)25-14-5-8-19-6-3-2-4-7-19/h2-4,6-7,9-12,15-16,18H,5,8,13-14,17H2,1H3,(H,25,28).
What are the key properties of 5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide?
5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide has a molecular weight of 374.49 g/mol, XLogP of 3.52, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[methyl(2-pyridin-4-ylethyl)amino]-N-(3-phenylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 109192949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).