3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide

C19H21ClN2O2 — CID 113125262

IUPAC3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide
SMILESCCc1ccccc1N(CCC(=O)Nc1cccc(Cl)c1)C(C)=O
InChIInChI=1S/C19H21ClN2O2/c1-3-15-7-4-5-10-18(15)22(14(2)23)12-11-19(24)21-17-9-6-8-16(20)13-17/h4-10,13H,3,11-12H2,1-2H3,(H,21,24)
InChIKeyQGYNIEACLDAXCO-UHFFFAOYSA-N
MW344.84 g/mol
LogP4.28
Rot. Bonds6

About 3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide

3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide (PubChem CID 113125262) has the molecular formula C19H21ClN2O2 and a molecular weight of 344.84 g/mol. Its IUPAC name is 3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide.

Molecular Properties

Compound Name3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide
PubChem CID113125262
Molecular FormulaC19H21ClN2O2
Molecular Weight344.84 g/mol
Exact Mass344.13
IUPAC Name3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide
SMILESCCc1ccccc1N(CCC(=O)Nc1cccc(Cl)c1)C(C)=O
InChIInChI=1S/C19H21ClN2O2/c1-3-15-7-4-5-10-18(15)22(14(2)23)12-11-19(24)21-17-9-6-8-16(20)13-17/h4-10,13H,3,11-12H2,1-2H3,(H,21,24)
InChIKeyQGYNIEACLDAXCO-UHFFFAOYSA-N
XLogP4.28
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.84
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide 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

3-(N-acetyl-2-bromoanilino)-N-(3-chlorophenyl)propanamide
CID 113132588
3-(N-acetyl-2,4-dimethylanilino)-N-(3-chlorophenyl)propanamide
CID 113124224
3-(N-acetyl-2,6-difluoroanilino)-N-(3-chlorophenyl)propanamide
CID 113135426
3-(N-acetyl-4-propan-2-ylanilino)-N-(3-chlorophenyl)propanamide
CID 113125911
3-(N-acetyl-2,4-dichloroanilino)-N-(3-acetylphenyl)propanamide
CID 113133926
methyl 4-[3-(N-acetyl-2-ethylanilino)propanoylamino]benzoate
CID 113125293
3-(N-acetyl-5-chloro-2-methylanilino)-N-(2-ethylphenyl)propanamide
CID 113127741
3-(N-acetyl-2,5-dichloroanilino)-N-(3-fluorophenyl)propanamide
CID 113134036
3-[acetyl(butan-2-yl)amino]-N-(3-chlorophenyl)propanamide
CID 113116225
3-(N-acetyl-4-chloro-2-methylanilino)-N-(3,5-dichlorophenyl)propanamide
CID 113127945
3-(N-acetyl-2-chloroanilino)-N-(2-ethylphenyl)propanamide
CID 113127100
N-(3-acetamidophenyl)-3-(N-acetyl-2-ethyl-6-methylanilino)propanamide
CID 113125623

Frequently Asked Questions

What is the IUPAC name of 3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide?
The IUPAC name of 3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide (CID 113125262) is 3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide.
What is the SMILES notation for 3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide?
The canonical SMILES for 3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide is CCc1ccccc1N(CCC(=O)Nc1cccc(Cl)c1)C(C)=O.
What is the InChIKey of 3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide?
The InChIKey is QGYNIEACLDAXCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O2/c1-3-15-7-4-5-10-18(15)22(14(2)23)12-11-19(24)21-17-9-6-8-16(20)13-17/h4-10,13H,3,11-12H2,1-2H3,(H,21,24).
What are the key properties of 3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide?
3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide has a molecular weight of 344.84 g/mol, XLogP of 4.28, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(N-acetyl-2-ethylanilino)-N-(3-chlorophenyl)propanamide is sourced from PubChem (CID 113125262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).