2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide

C23H24ClN3O2 — CID 11315821

IUPAC2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide
SMILESCOc1cccc(C(Nc2ccc(C)cc2Cl)C(=O)NCCc2ccncc2)c1
InChIInChI=1S/C23H24ClN3O2/c1-16-6-7-21(20(24)14-16)27-22(18-4-3-5-19(15-18)29-2)23(28)26-13-10-17-8-11-25-12-9-17/h3-9,11-12,14-15,22,27H,10,13H2,1-2H3,(H,26,28)
InChIKeySOMANYAPLLAZMY-UHFFFAOYSA-N
MW409.92 g/mol
LogP4.56
Rot. Bonds8

About 2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide

2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide (PubChem CID 11315821) has the molecular formula C23H24ClN3O2 and a molecular weight of 409.92 g/mol. Its IUPAC name is 2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide
PubChem CID11315821
Molecular FormulaC23H24ClN3O2
Molecular Weight409.92 g/mol
Exact Mass409.16
IUPAC Name2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide
SMILESCOc1cccc(C(Nc2ccc(C)cc2Cl)C(=O)NCCc2ccncc2)c1
InChIInChI=1S/C23H24ClN3O2/c1-16-6-7-21(20(24)14-16)27-22(18-4-3-5-19(15-18)29-2)23(28)26-13-10-17-8-11-25-12-9-17/h3-9,11-12,14-15,22,27H,10,13H2,1-2H3,(H,26,28)
InChIKeySOMANYAPLLAZMY-UHFFFAOYSA-N
XLogP4.56
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.92
LogP ≤ 54.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-chloro-4-methylanilino)-2-(2-ethenylphenyl)-N-(2-pyridin-4-ylethyl)acetamide
CID 11384204
2-(2-bromophenyl)-2-(2,4-dichloroanilino)-N-(2-pyridin-4-ylethyl)acetamide
CID 10254516
2-(3-bromophenyl)-N-(2-pyridin-4-ylethyl)-2-(2-pyridin-4-ylethylamino)acetamide
CID 56932437
1-(3-methoxyphenyl)-3-(2-pyridin-4-ylethyl)urea
CID 5297462
1-(3-methoxyphenyl)-2-(2-pyridin-4-ylethylamino)ethanol
CID 81133898
2-(2-methylphenyl)-2-[4-methyl-2-(trifluoromethyl)anilino]-N-(2-pyridin-4-ylethyl)acetamide
CID 11281764
1-(3-methoxyphenyl)-3-pyridin-4-ylpropan-1-amine
CID 105086648
2-chloro-N-[2-(3-methoxyphenyl)ethyl]-2-phenylacetamide
CID 107851262
2-(4-chlorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-3-pyridin-4-ylpropanamide
CID 110296857
N-(2-chloro-4-methylphenyl)-3-[[N-[2-(4-methoxyphenyl)ethyl]-N'-methylcarbamimidoyl]amino]propanamide;hydroiodide
CID 111170654
N-(3-methoxyphenyl)-3-pyridin-4-ylpropanamide
CID 110468427
2-chloro-N-[2-(3-methoxyphenyl)ethyl]propanamide
CID 103881563

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide?
The IUPAC name of 2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide (CID 11315821) is 2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide?
The canonical SMILES for 2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide is COc1cccc(C(Nc2ccc(C)cc2Cl)C(=O)NCCc2ccncc2)c1.
What is the InChIKey of 2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide?
The InChIKey is SOMANYAPLLAZMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClN3O2/c1-16-6-7-21(20(24)14-16)27-22(18-4-3-5-19(15-18)29-2)23(28)26-13-10-17-8-11-25-12-9-17/h3-9,11-12,14-15,22,27H,10,13H2,1-2H3,(H,26,28).
What are the key properties of 2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide?
2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide has a molecular weight of 409.92 g/mol, XLogP of 4.56, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-methylanilino)-2-(3-methoxyphenyl)-N-(2-pyridin-4-ylethyl)acetamide is sourced from PubChem (CID 11315821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).