N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide

C19H23ClN2O3S — CID 132660099

IUPACN-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide
SMILESCCc1ccc(N(C(C)C(=O)Nc2cccc(Cl)c2C)S(C)(=O)=O)cc1
InChIInChI=1S/C19H23ClN2O3S/c1-5-15-9-11-16(12-10-15)22(26(4,24)25)14(3)19(23)21-18-8-6-7-17(20)13(18)2/h6-12,14H,5H2,1-4H3,(H,21,23)
InChIKeyYNBTZANWXAIJBP-UHFFFAOYSA-N
MW394.92 g/mol
LogP4.00
Rot. Bonds6

About N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide

N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide (PubChem CID 132660099) has the molecular formula C19H23ClN2O3S and a molecular weight of 394.92 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide
PubChem CID132660099
Molecular FormulaC19H23ClN2O3S
Molecular Weight394.92 g/mol
Exact Mass394.11
IUPAC NameN-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide
SMILESCCc1ccc(N(C(C)C(=O)Nc2cccc(Cl)c2C)S(C)(=O)=O)cc1
InChIInChI=1S/C19H23ClN2O3S/c1-5-15-9-11-16(12-10-15)22(26(4,24)25)14(3)19(23)21-18-8-6-7-17(20)13(18)2/h6-12,14H,5H2,1-4H3,(H,21,23)
InChIKeyYNBTZANWXAIJBP-UHFFFAOYSA-N
XLogP4.00
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.92
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)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

N-(3-chloro-2-methylphenyl)-2-(4-chloro-N-methylsulfonylanilino)propanamide
CID 4311330
2-(4-ethyl-N-methylsulfonylanilino)-N-(2-methyl-3-nitrophenyl)propanamide
CID 132662550
(2R)-2-(4-chloro-N-methylsulfonylanilino)-N-(4-ethylphenyl)propanamide
CID 1265335
2-(4-chloro-N-methylsulfonylanilino)-N-(4-ethylphenyl)propanamide
CID 2968377
N-(3-chloro-2-methylphenyl)-3-(4-ethyl-N-methylsulfonylanilino)propanamide
CID 113142859
N-(3-chloro-2-methylphenyl)-2-(2,5-dichloro-N-methylsulfonylanilino)propanamide
CID 132670639
(2S)-N-(2,3-dichlorophenyl)-2-(4-ethoxy-N-methylsulfonylanilino)propanamide
CID 126269148
(2S)-N-(2-chlorophenyl)-2-(4-ethoxy-N-methylsulfonylanilino)propanamide
CID 1322346
2-(4-ethyl-N-methylsulfonylanilino)-N-(4-propan-2-ylphenyl)propanamide
CID 132658835
methyl 3-[[(2R)-2-(4-ethoxy-N-methylsulfonylanilino)propanoyl]amino]-2-methylbenzoate
CID 126266508
N-(2-chlorophenyl)-2-(3,4-dichloro-N-methylsulfonylanilino)propanamide
CID 132666717
2-(4-ethyl-N-methylsulfonylanilino)-N-(3-methoxyphenyl)propanamide
CID 132656595

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide (CID 132660099) is N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide is CCc1ccc(N(C(C)C(=O)Nc2cccc(Cl)c2C)S(C)(=O)=O)cc1.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide?
The InChIKey is YNBTZANWXAIJBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O3S/c1-5-15-9-11-16(12-10-15)22(26(4,24)25)14(3)19(23)21-18-8-6-7-17(20)13(18)2/h6-12,14H,5H2,1-4H3,(H,21,23).
What are the key properties of N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide?
N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide has a molecular weight of 394.92 g/mol, XLogP of 4.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-2-(4-ethyl-N-methylsulfonylanilino)propanamide is sourced from PubChem (CID 132660099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).