2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide

C19H17Cl2N3O2 — CID 110625376

IUPAC2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide
SMILESO=C(CNC(=O)Cc1c[nH]c2ccc(Cl)cc12)NCc1ccc(Cl)cc1
InChIInChI=1S/C19H17Cl2N3O2/c20-14-3-1-12(2-4-14)9-23-19(26)11-24-18(25)7-13-10-22-17-6-5-15(21)8-16(13)17/h1-6,8,10,22H,7,9,11H2,(H,23,26)(H,24,25)
InChIKeyZWKJZYLONXQUAO-UHFFFAOYSA-N
MW390.27 g/mol
LogP3.45
Rot. Bonds6

About 2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide

2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide (PubChem CID 110625376) has the molecular formula C19H17Cl2N3O2 and a molecular weight of 390.27 g/mol. Its IUPAC name is 2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide
PubChem CID110625376
Molecular FormulaC19H17Cl2N3O2
Molecular Weight390.27 g/mol
Exact Mass389.07
IUPAC Name2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide
SMILESO=C(CNC(=O)Cc1c[nH]c2ccc(Cl)cc12)NCc1ccc(Cl)cc1
InChIInChI=1S/C19H17Cl2N3O2/c20-14-3-1-12(2-4-14)9-23-19(26)11-24-18(25)7-13-10-22-17-6-5-15(21)8-16(13)17/h1-6,8,10,22H,7,9,11H2,(H,23,26)(H,24,25)
InChIKeyZWKJZYLONXQUAO-UHFFFAOYSA-N
XLogP3.45
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.27
LogP ≤ 53.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]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-(5-chloro-1H-indol-3-yl)-N-[(4-chlorophenyl)methyl]acetamide
CID 113209503
2-(5-chloro-1H-indol-3-yl)-N-[2-(3-chlorophenyl)ethyl]acetamide
CID 113209520
N-(3-acetamidopropyl)-2-(5-chloro-1H-indol-3-yl)acetamide
CID 110630730
2-(5-chloro-1H-indol-3-yl)-N-methoxyacetamide
CID 110611810
2-(5-chloro-1H-indol-3-yl)-N-[2-[(1,1-dioxothiolan-3-yl)amino]-2-oxoethyl]acetamide
CID 110606031
N-[2-(4-chlorophenyl)ethyl]-2-(1H-indol-3-yl)acetamide
CID 2114473
methyl N-[2-[2-(5-chloro-1H-indol-3-yl)ethylamino]-2-oxoethyl]carbamate
CID 71994383
2-(5-chloro-1H-indol-3-yl)acetate
CID 21122976
N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-2-(4-methoxyphenyl)acetamide
CID 110285268
N-[(4-chlorophenyl)methyl]-2-(2,4-dichlorophenyl)acetamide
CID 1226021
N-[(4-chlorophenyl)methyl]-4-(1H-indol-3-yl)butanamide
CID 2114507
1-(5-chloro-1H-indol-3-yl)-3-methylbutan-2-one
CID 166554148

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide?
The IUPAC name of 2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide (CID 110625376) is 2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide?
The canonical SMILES for 2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide is O=C(CNC(=O)Cc1c[nH]c2ccc(Cl)cc12)NCc1ccc(Cl)cc1.
What is the InChIKey of 2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide?
The InChIKey is ZWKJZYLONXQUAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17Cl2N3O2/c20-14-3-1-12(2-4-14)9-23-19(26)11-24-18(25)7-13-10-22-17-6-5-15(21)8-16(13)17/h1-6,8,10,22H,7,9,11H2,(H,23,26)(H,24,25).
What are the key properties of 2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide?
2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide has a molecular weight of 390.27 g/mol, XLogP of 3.45, 6 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide is sourced from PubChem (CID 110625376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).