N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide

C22H23N3O — CID 113017495

IUPACN-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
SMILESCCc1ccc(Nc2ccc(NC(=O)Cc3cccc(C)c3)cn2)cc1
InChIInChI=1S/C22H23N3O/c1-3-17-7-9-19(10-8-17)24-21-12-11-20(15-23-21)25-22(26)14-18-6-4-5-16(2)13-18/h4-13,15H,3,14H2,1-2H3,(H,23,24)(H,25,26)
InChIKeyVYKQDGBZZABUBB-UHFFFAOYSA-N
MW345.45 g/mol
LogP4.88
Rot. Bonds6

About N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide

N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide (PubChem CID 113017495) has the molecular formula C22H23N3O and a molecular weight of 345.45 g/mol. Its IUPAC name is N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
PubChem CID113017495
Molecular FormulaC22H23N3O
Molecular Weight345.45 g/mol
Exact Mass345.18
IUPAC NameN-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
SMILESCCc1ccc(Nc2ccc(NC(=O)Cc3cccc(C)c3)cn2)cc1
InChIInChI=1S/C22H23N3O/c1-3-17-7-9-19(10-8-17)24-21-12-11-20(15-23-21)25-22(26)14-18-6-4-5-16(2)13-18/h4-13,15H,3,14H2,1-2H3,(H,23,24)(H,25,26)
InChIKeyVYKQDGBZZABUBB-UHFFFAOYSA-N
XLogP4.88
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 54.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(4-tert-butylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113018155
N-[6-(4-methoxyanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113019533
N-[6-(3,4-dichloroanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113022187
N-[6-(3,4-dimethoxyanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113020115
N-[6-(2-chloroanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113018452
N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113032512
2-(3-methylphenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide
CID 113023476
2-(4-methylphenyl)-N-[6-[(3-methylphenyl)methylamino]-3-pyridinyl]acetamide
CID 113011699
N-(6-anilino-3-pyridinyl)-2-(3-fluorophenyl)acetamide
CID 113016055
2-(3-methylphenyl)-N-[6-(quinolin-8-ylamino)-3-pyridinyl]acetamide
CID 113021762
N-[6-(2-cyanoanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113022692
N-[6-(3-methylanilino)-3-pyridinyl]butanamide
CID 113016196

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide?
The IUPAC name of N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide (CID 113017495) is N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide is CCc1ccc(Nc2ccc(NC(=O)Cc3cccc(C)c3)cn2)cc1.
What is the InChIKey of N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide?
The InChIKey is VYKQDGBZZABUBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O/c1-3-17-7-9-19(10-8-17)24-21-12-11-20(15-23-21)25-22(26)14-18-6-4-5-16(2)13-18/h4-13,15H,3,14H2,1-2H3,(H,23,24)(H,25,26).
What are the key properties of N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide?
N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide has a molecular weight of 345.45 g/mol, XLogP of 4.88, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-ethylanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 113017495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).