5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide

C23H24FN3O — CID 109236445

IUPAC5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
SMILESCCc1cccc(C)c1Nc1cncc(C(=O)NCCc2ccc(F)cc2)c1
InChIInChI=1S/C23H24FN3O/c1-3-18-6-4-5-16(2)22(18)27-21-13-19(14-25-15-21)23(28)26-12-11-17-7-9-20(24)10-8-17/h4-10,13-15,27H,3,11-12H2,1-2H3,(H,26,28)
InChIKeyIFYSVIAMDGHRRG-UHFFFAOYSA-N
MW377.46 g/mol
LogP4.81
Rot. Bonds7

About 5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide

5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide (PubChem CID 109236445) has the molecular formula C23H24FN3O and a molecular weight of 377.46 g/mol. Its IUPAC name is 5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
PubChem CID109236445
Molecular FormulaC23H24FN3O
Molecular Weight377.46 g/mol
Exact Mass377.19
IUPAC Name5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
SMILESCCc1cccc(C)c1Nc1cncc(C(=O)NCCc2ccc(F)cc2)c1
InChIInChI=1S/C23H24FN3O/c1-3-18-6-4-5-16(2)22(18)27-21-13-19(14-25-15-21)23(28)26-12-11-17-7-9-20(24)10-8-17/h4-10,13-15,27H,3,11-12H2,1-2H3,(H,26,28)
InChIKeyIFYSVIAMDGHRRG-UHFFFAOYSA-N
XLogP4.81
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.46
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethyl-6-methylphenyl)-5-(2-phenylethylamino)pyridine-3-carboxamide
CID 109235944
5-(3-chloroanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 109236453
N-[(4-fluorophenyl)methyl]-5-(2-methyl-6-propan-2-ylanilino)pyridine-3-carboxamide
CID 109233596
5-(2,4-difluoroanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 109236485
5-[4-(dimethylamino)anilino]-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 109236480
N-(2-ethyl-6-methylphenyl)-5-[2-(2-fluorophenyl)ethylamino]pyridine-3-carboxamide
CID 109236356
N-(2,6-dimethylphenyl)-5-(4-fluoroanilino)pyridine-3-carboxamide
CID 109243122
5-(2,6-dimethylanilino)-N-(2-methoxyethyl)pyridine-3-carboxamide
CID 109227724
N-[2-(4-fluorophenyl)ethyl]-5-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109228217
5-(2-ethyl-6-methylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109243738
5-N-(4-fluorophenyl)-3-N-[2-(4-fluorophenyl)ethyl]pyridine-3,5-dicarboxamide
CID 109106374
5-[2-(4-fluorophenyl)ethylamino]-N-(2-methoxyethyl)pyridine-3-carboxamide
CID 109227666

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide (CID 109236445) is 5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide is CCc1cccc(C)c1Nc1cncc(C(=O)NCCc2ccc(F)cc2)c1.
What is the InChIKey of 5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide?
The InChIKey is IFYSVIAMDGHRRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24FN3O/c1-3-18-6-4-5-16(2)22(18)27-21-13-19(14-25-15-21)23(28)26-12-11-17-7-9-20(24)10-8-17/h4-10,13-15,27H,3,11-12H2,1-2H3,(H,26,28).
What are the key properties of 5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide?
5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide has a molecular weight of 377.46 g/mol, XLogP of 4.81, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethyl-6-methylanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 109236445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).