N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide

C21H20FN3O — CID 113032512

IUPACN-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide
SMILESCCc1ccc(Nc2ccc(NC(=O)Cc3cccc(F)c3)nc2)cc1
InChIInChI=1S/C21H20FN3O/c1-2-15-6-8-18(9-7-15)24-19-10-11-20(23-14-19)25-21(26)13-16-4-3-5-17(22)12-16/h3-12,14,24H,2,13H2,1H3,(H,23,25,26)
InChIKeyWVEIDLOXTDYDDM-UHFFFAOYSA-N
MW349.41 g/mol
LogP4.71
Rot. Bonds6

About N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide

N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide (PubChem CID 113032512) has the molecular formula C21H20FN3O and a molecular weight of 349.41 g/mol. Its IUPAC name is N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide
PubChem CID113032512
Molecular FormulaC21H20FN3O
Molecular Weight349.41 g/mol
Exact Mass349.16
IUPAC NameN-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide
SMILESCCc1ccc(Nc2ccc(NC(=O)Cc3cccc(F)c3)nc2)cc1
InChIInChI=1S/C21H20FN3O/c1-2-15-6-8-18(9-7-15)24-19-10-11-20(23-14-19)25-21(26)13-16-4-3-5-17(22)12-16/h3-12,14,24H,2,13H2,1H3,(H,23,25,26)
InChIKeyWVEIDLOXTDYDDM-UHFFFAOYSA-N
XLogP4.71
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.41
LogP ≤ 54.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-(4-acetamidoanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113035220
2-(3-fluorophenyl)-N-[5-(3-methylanilino)-2-pyridinyl]acetamide
CID 113031460
N-(6-anilino-3-pyridinyl)-2-(3-fluorophenyl)acetamide
CID 113016055
N-[5-(2,5-dimethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113032051
N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113017495
2-(3-fluorophenyl)-N-[5-[(4-methoxyphenyl)methylamino]-2-pyridinyl]acetamide
CID 113027442
2-(3-fluorophenyl)-N-[5-(prop-2-enylamino)-2-pyridinyl]acetamide
CID 113023879
2-(3-fluorophenyl)-N-[6-(2-methylanilino)-3-pyridinyl]acetamide
CID 113016132
methyl 3-[[6-[[2-(4-fluorophenyl)acetyl]amino]-3-pyridinyl]amino]benzoate
CID 113035333
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113017296
N-[5-(4-ethylanilino)-2-pyridinyl]-3-methylbutanamide
CID 113032476
N-[5-(2,6-dimethylanilino)-2-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113032265

Frequently Asked Questions

What is the IUPAC name of N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide?
The IUPAC name of N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide (CID 113032512) is N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide.
What is the SMILES notation for N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide?
The canonical SMILES for N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide is CCc1ccc(Nc2ccc(NC(=O)Cc3cccc(F)c3)nc2)cc1.
What is the InChIKey of N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide?
The InChIKey is WVEIDLOXTDYDDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FN3O/c1-2-15-6-8-18(9-7-15)24-19-10-11-20(23-14-19)25-21(26)13-16-4-3-5-17(22)12-16/h3-12,14,24H,2,13H2,1H3,(H,23,25,26).
What are the key properties of N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide?
N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide has a molecular weight of 349.41 g/mol, XLogP of 4.71, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide is sourced from PubChem (CID 113032512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).