2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide

C22H23N3O — CID 137432611

IUPAC2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide
SMILESCCc1ccc(C(NC)C(=O)Nc2ccc(-c3ccncc3)cc2)cc1
InChIInChI=1S/C22H23N3O/c1-3-16-4-6-19(7-5-16)21(23-2)22(26)25-20-10-8-17(9-11-20)18-12-14-24-15-13-18/h4-15,21,23H,3H2,1-2H3,(H,25,26)
InChIKeyVXBQZALXZQEUSE-UHFFFAOYSA-N
MW345.45 g/mol
LogP4.21
Rot. Bonds6

About 2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide

2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide (PubChem CID 137432611) has the molecular formula C22H23N3O and a molecular weight of 345.45 g/mol. Its IUPAC name is 2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide
PubChem CID137432611
Molecular FormulaC22H23N3O
Molecular Weight345.45 g/mol
Exact Mass345.18
IUPAC Name2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide
SMILESCCc1ccc(C(NC)C(=O)Nc2ccc(-c3ccncc3)cc2)cc1
InChIInChI=1S/C22H23N3O/c1-3-16-4-6-19(7-5-16)21(23-2)22(26)25-20-10-8-17(9-11-20)18-12-14-24-15-13-18/h4-15,21,23H,3H2,1-2H3,(H,25,26)
InChIKeyVXBQZALXZQEUSE-UHFFFAOYSA-N
XLogP4.21
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 ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(4-pyridin-4-ylphenyl)propanamide
CID 110460098
N-(4-ethylphenyl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide
CID 4825202
(2S)-2-(methylamino)-N-pyridin-4-ylpropanamide
CID 59361167
1-(4-ethylphenyl)-N-methyl-1-pyridin-4-ylmethanamine
CID 43484668
4-ethyl-N-pyridin-4-ylbenzamide
CID 2712552
(2S)-2-amino-3,3-dimethyl-N-(4-pyridin-4-ylphenyl)butanamide
CID 175833956
2-(methylamino)-2-phenyl-N-(4-propan-2-ylphenyl)acetamide;hydrochloride
CID 146675512
2-(4-ethylphenyl)-2-fluoro-N-(4-hydroxyphenyl)acetamide
CID 151497177
1-(4-ethylphenyl)-3-(4-propan-2-ylphenyl)urea
CID 4111810
(2S)-2-bromo-N-(4-ethylphenyl)butanamide
CID 51659893
N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide
CID 55726687
N-methyl-2-(4-pyridin-4-ylphenyl)acetamide
CID 39801868

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide?
The IUPAC name of 2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide (CID 137432611) is 2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide?
The canonical SMILES for 2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide is CCc1ccc(C(NC)C(=O)Nc2ccc(-c3ccncc3)cc2)cc1.
What is the InChIKey of 2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide?
The InChIKey is VXBQZALXZQEUSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O/c1-3-16-4-6-19(7-5-16)21(23-2)22(26)25-20-10-8-17(9-11-20)18-12-14-24-15-13-18/h4-15,21,23H,3H2,1-2H3,(H,25,26).
What are the key properties of 2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide?
2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide has a molecular weight of 345.45 g/mol, XLogP of 4.21, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenyl)-2-(methylamino)-N-(4-pyridin-4-ylphenyl)acetamide is sourced from PubChem (CID 137432611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).