N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide

C17H13Cl2FN2O2 — CID 11394487

IUPACN-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide
SMILESO=C(CN1C(=O)Cc2cc(Cl)ccc21)NCc1c(F)cccc1Cl
InChIInChI=1S/C17H13Cl2FN2O2/c18-11-4-5-15-10(6-11)7-17(24)22(15)9-16(23)21-8-12-13(19)2-1-3-14(12)20/h1-6H,7-9H2,(H,21,23)
InChIKeyLLKJZDONTVVDKL-UHFFFAOYSA-N
MW367.21 g/mol
LogP3.34
Rot. Bonds4

About N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide

N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide (PubChem CID 11394487) has the molecular formula C17H13Cl2FN2O2 and a molecular weight of 367.21 g/mol. Its IUPAC name is N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide.

Molecular Properties

Compound NameN-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide
PubChem CID11394487
Molecular FormulaC17H13Cl2FN2O2
Molecular Weight367.21 g/mol
Exact Mass366.03
IUPAC NameN-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide
SMILESO=C(CN1C(=O)Cc2cc(Cl)ccc21)NCc1c(F)cccc1Cl
InChIInChI=1S/C17H13Cl2FN2O2/c18-11-4-5-15-10(6-11)7-17(24)22(15)9-16(23)21-8-12-13(19)2-1-3-14(12)20/h1-6H,7-9H2,(H,21,23)
InChIKeyLLKJZDONTVVDKL-UHFFFAOYSA-N
XLogP3.34
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.21
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide?
The IUPAC name of N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide (CID 11394487) is N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide.
What is the SMILES notation for N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide?
The canonical SMILES for N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide is O=C(CN1C(=O)Cc2cc(Cl)ccc21)NCc1c(F)cccc1Cl.
What is the InChIKey of N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide?
The InChIKey is LLKJZDONTVVDKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13Cl2FN2O2/c18-11-4-5-15-10(6-11)7-17(24)22(15)9-16(23)21-8-12-13(19)2-1-3-14(12)20/h1-6H,7-9H2,(H,21,23).
What are the key properties of N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide?
N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide has a molecular weight of 367.21 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chloro-6-fluorophenyl)methyl]-2-(5-chloro-2-oxo-3H-indol-1-yl)acetamide is sourced from PubChem (CID 11394487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).