N-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide

C14H14Cl2N2OS — CID 2555867

IUPACN-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide
SMILESCN(CC(=O)Nc1cc(Cl)cc(Cl)c1)Cc1cccs1
InChIInChI=1S/C14H14Cl2N2OS/c1-18(8-13-3-2-4-20-13)9-14(19)17-12-6-10(15)5-11(16)7-12/h2-7H,8-9H2,1H3,(H,17,19)
InChIKeyOCUAXYJLWBIQBF-UHFFFAOYSA-N
MW329.25 g/mol
LogP4.13
Rot. Bonds5

About N-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide

N-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide (PubChem CID 2555867) has the molecular formula C14H14Cl2N2OS and a molecular weight of 329.25 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide
PubChem CID2555867
Molecular FormulaC14H14Cl2N2OS
Molecular Weight329.25 g/mol
Exact Mass328.02
IUPAC NameN-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide
SMILESCN(CC(=O)Nc1cc(Cl)cc(Cl)c1)Cc1cccs1
InChIInChI=1S/C14H14Cl2N2OS/c1-18(8-13-3-2-4-20-13)9-14(19)17-12-6-10(15)5-11(16)7-12/h2-7H,8-9H2,1H3,(H,17,19)
InChIKeyOCUAXYJLWBIQBF-UHFFFAOYSA-N
XLogP4.13
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.25
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]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-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide?
The IUPAC name of N-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide (CID 2555867) is N-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide is CN(CC(=O)Nc1cc(Cl)cc(Cl)c1)Cc1cccs1.
What is the InChIKey of N-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide?
The InChIKey is OCUAXYJLWBIQBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N2OS/c1-18(8-13-3-2-4-20-13)9-14(19)17-12-6-10(15)5-11(16)7-12/h2-7H,8-9H2,1H3,(H,17,19).
What are the key properties of N-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide?
N-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide has a molecular weight of 329.25 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide is sourced from PubChem (CID 2555867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).