N-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide

C18H16Cl2N2O — CID 113212316

IUPACN-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide
SMILESCc1ccc2[nH]c(C)c(CC(=O)Nc3cccc(Cl)c3Cl)c2c1
InChIInChI=1S/C18H16Cl2N2O/c1-10-6-7-15-13(8-10)12(11(2)21-15)9-17(23)22-16-5-3-4-14(19)18(16)20/h3-8,21H,9H2,1-2H3,(H,22,23)
InChIKeyWOEOIEPCGFXSHD-UHFFFAOYSA-N
MW347.25 g/mol
LogP5.27
Rot. Bonds3

About N-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide

N-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide (PubChem CID 113212316) has the molecular formula C18H16Cl2N2O and a molecular weight of 347.25 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide
PubChem CID113212316
Molecular FormulaC18H16Cl2N2O
Molecular Weight347.25 g/mol
Exact Mass346.06
IUPAC NameN-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide
SMILESCc1ccc2[nH]c(C)c(CC(=O)Nc3cccc(Cl)c3Cl)c2c1
InChIInChI=1S/C18H16Cl2N2O/c1-10-6-7-15-13(8-10)12(11(2)21-15)9-17(23)22-16-5-3-4-14(19)18(16)20/h3-8,21H,9H2,1-2H3,(H,22,23)
InChIKeyWOEOIEPCGFXSHD-UHFFFAOYSA-N
XLogP5.27
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.25
LogP ≤ 55.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

methyl 4-chloro-3-[[2-(2,5-dimethyl-1H-indol-3-yl)acetyl]amino]benzoate
CID 113212303
N-[1-(2-chlorophenyl)ethyl]-2-(2,5-dimethyl-1H-indol-3-yl)acetamide
CID 46588719
2-(5-bromo-2-methyl-1H-indol-3-yl)-N-(2-hydroxy-4-methylphenyl)acetamide
CID 46450419
2-(5-chloro-2-methyl-1H-indol-3-yl)-N-(5-chloro-2-methylphenyl)acetamide
CID 113212020
2-(5-chloro-2-methyl-1H-indol-3-yl)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 113212039
N-(2,4-dimethylphenyl)-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide
CID 113212169
N'-[2-(2,5-dimethyl-1H-indol-3-yl)acetyl]-2-(1H-indol-3-yl)acetohydrazide
CID 31905462
N-(2-hydroxyphenyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 31984043
N-(2,3-dichlorophenyl)-2-(5-methyl-1H-pyrrol-3-yl)acetamide
CID 112524517
N-(3-bromophenyl)-2-(5-chloro-2-methyl-1H-indol-3-yl)acetamide
CID 113212058
N-(2-tert-butylphenyl)-2-(5-fluoro-2-methyl-1H-indol-3-yl)acetamide
CID 113211880
2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(4-methylphenyl)acetamide
CID 31855827

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide (CID 113212316) is N-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide is Cc1ccc2[nH]c(C)c(CC(=O)Nc3cccc(Cl)c3Cl)c2c1.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide?
The InChIKey is WOEOIEPCGFXSHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16Cl2N2O/c1-10-6-7-15-13(8-10)12(11(2)21-15)9-17(23)22-16-5-3-4-14(19)18(16)20/h3-8,21H,9H2,1-2H3,(H,22,23).
What are the key properties of N-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide?
N-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide has a molecular weight of 347.25 g/mol, XLogP of 5.27, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-(2,5-dimethyl-1H-indol-3-yl)acetamide is sourced from PubChem (CID 113212316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).