(2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide

C10H11Cl2NO3 — CID 95293041

IUPAC(2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide
SMILESCONC(=O)[C@H](C)Oc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C10H11Cl2NO3/c1-6(10(14)13-15-2)16-9-4-7(11)3-8(12)5-9/h3-6H,1-2H3,(H,13,14)/t6-/m0/s1
InChIKeyWQRSVZWFLXFPPV-LURJTMIESA-N
MW264.11 g/mol
LogP2.44
Rot. Bonds4

About (2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide

(2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide (PubChem CID 95293041) has the molecular formula C10H11Cl2NO3 and a molecular weight of 264.11 g/mol. Its IUPAC name is (2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide.

Molecular Properties

Compound Name(2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide
PubChem CID95293041
Molecular FormulaC10H11Cl2NO3
Molecular Weight264.11 g/mol
Exact Mass263.01
IUPAC Name(2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide
SMILESCONC(=O)[C@H](C)Oc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C10H11Cl2NO3/c1-6(10(14)13-15-2)16-9-4-7(11)3-8(12)5-9/h3-6H,1-2H3,(H,13,14)/t6-/m0/s1
InChIKeyWQRSVZWFLXFPPV-LURJTMIESA-N
XLogP2.44
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.11
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide 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-(3-Chlorophenoxy)propanehydrazide
CID 2832641
2-(2,4-Dichlorophenoxy)acetamide
CID 74798
2-(2,4-Dichlorophenoxy)-n-hydroxyacetamide
CID 239786
Acetamide, 2-(4-chlorophenoxy)-N-hydroxy-
CID 11183280
4-Chlorophenoxyacetamide
CID 97091
2-(2-Chlorophenoxy)acetamide
CID 97329
2-(3,4-dichlorophenoxy)-N-hydroxyacetamide
CID 145984790
2-(4-Chlorophenoxy)-2-methylpropanamide
CID 165334
2-(3-Chlorophenoxy)propionamide
CID 22078
3-(3-chlorophenoxy)-N-hydroxypropanamide
CID 145983362
2-(2,5-dichlorophenoxy)-N-hydroxyacetamide
CID 145984703
2-(3,5-dichlorophenoxy)-N-hydroxyacetamide
CID 145986005

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide?
The IUPAC name of (2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide (CID 95293041) is (2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide.
What is the SMILES notation for (2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide?
The canonical SMILES for (2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide is CONC(=O)[C@H](C)Oc1cc(Cl)cc(Cl)c1.
What is the InChIKey of (2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide?
The InChIKey is WQRSVZWFLXFPPV-LURJTMIESA-N. The full InChI is InChI=1S/C10H11Cl2NO3/c1-6(10(14)13-15-2)16-9-4-7(11)3-8(12)5-9/h3-6H,1-2H3,(H,13,14)/t6-/m0/s1.
What are the key properties of (2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide?
(2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide has a molecular weight of 264.11 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(3,5-dichlorophenoxy)-N-methoxypropanamide is sourced from PubChem (CID 95293041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).