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

C23H24FN3O — CID 109157535

IUPAC6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
SMILESCCN(Cc1ccccc1)c1ccc(C(=O)NCCc2ccc(F)cc2)cn1
InChIInChI=1S/C23H24FN3O/c1-2-27(17-19-6-4-3-5-7-19)22-13-10-20(16-26-22)23(28)25-15-14-18-8-11-21(24)12-9-18/h3-13,16H,2,14-15,17H2,1H3,(H,25,28)
InChIKeyZTHKAYOXZSEAEZ-UHFFFAOYSA-N
MW377.46 g/mol
LogP4.22
Rot. Bonds8

About 6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide

6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide (PubChem CID 109157535) has the molecular formula C23H24FN3O and a molecular weight of 377.46 g/mol. Its IUPAC name is 6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
PubChem CID109157535
Molecular FormulaC23H24FN3O
Molecular Weight377.46 g/mol
Exact Mass377.19
IUPAC Name6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
SMILESCCN(Cc1ccccc1)c1ccc(C(=O)NCCc2ccc(F)cc2)cn1
InChIInChI=1S/C23H24FN3O/c1-2-27(17-19-6-4-3-5-7-19)22-13-10-20(16-26-22)23(28)25-15-14-18-8-11-21(24)12-9-18/h3-13,16H,2,14-15,17H2,1H3,(H,25,28)
InChIKeyZTHKAYOXZSEAEZ-UHFFFAOYSA-N
XLogP4.22
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.46
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[benzyl(ethyl)amino]-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 109157538
6-[benzyl(ethyl)amino]-N-(3-methylbutyl)pyridine-3-carboxamide
CID 109157548
5-[benzyl(ethyl)amino]-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide
CID 109282839
6-[benzyl(ethyl)amino]-N-butan-2-ylpyridine-3-carboxamide
CID 109152040
6-[benzyl(ethyl)amino]-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 109153623
6-(dimethylamino)-N-[2-(3-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 39471295
6-(dipropylamino)-N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide
CID 109156713
6-(diethylamino)-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 110907815
N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-4-methylbenzamide
CID 113012579
N-[2-(4-fluorophenyl)ethyl]-6-methoxypyridine-3-carboxamide
CID 27019140
6-[methyl(2-pyridin-4-ylethyl)amino]-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109158287
6-(diethylamino)-N-(3-hydroxy-3-phenylpropyl)pyridine-3-carboxamide
CID 111471680

Frequently Asked Questions

What is the IUPAC name of 6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide (CID 109157535) is 6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide is CCN(Cc1ccccc1)c1ccc(C(=O)NCCc2ccc(F)cc2)cn1.
What is the InChIKey of 6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide?
The InChIKey is ZTHKAYOXZSEAEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24FN3O/c1-2-27(17-19-6-4-3-5-7-19)22-13-10-20(16-26-22)23(28)25-15-14-18-8-11-21(24)12-9-18/h3-13,16H,2,14-15,17H2,1H3,(H,25,28).
What are the key properties of 6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide?
6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide has a molecular weight of 377.46 g/mol, XLogP of 4.22, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 109157535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).