2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide

C14H20Cl2N2O2 — CID 43515771

IUPAC2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide
SMILESCCNCc1cc(Cl)cc(Cl)c1OC(C)C(=O)NCC
InChIInChI=1S/C14H20Cl2N2O2/c1-4-17-8-10-6-11(15)7-12(16)13(10)20-9(3)14(19)18-5-2/h6-7,9,17H,4-5,8H2,1-3H3,(H,18,19)
InChIKeyCBHHGYRCUGYUOE-UHFFFAOYSA-N
MW319.23 g/mol
LogP3.01
Rot. Bonds7

About 2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide

2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide (PubChem CID 43515771) has the molecular formula C14H20Cl2N2O2 and a molecular weight of 319.23 g/mol. Its IUPAC name is 2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide.

Molecular Properties

Compound Name2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide
PubChem CID43515771
Molecular FormulaC14H20Cl2N2O2
Molecular Weight319.23 g/mol
Exact Mass318.09
IUPAC Name2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide
SMILESCCNCc1cc(Cl)cc(Cl)c1OC(C)C(=O)NCC
InChIInChI=1S/C14H20Cl2N2O2/c1-4-17-8-10-6-11(15)7-12(16)13(10)20-9(3)14(19)18-5-2/h6-7,9,17H,4-5,8H2,1-3H3,(H,18,19)
InChIKeyCBHHGYRCUGYUOE-UHFFFAOYSA-N
XLogP3.01
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.23
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide 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-[2,4-dichloro-6-(methylaminomethyl)phenoxy]-N-ethylpropanamide
CID 43515707
N-carbamoyl-2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]propanamide
CID 43515774
N-cyclopropyl-2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]propanamide
CID 43515770
2-[2,4-dichloro-6-(methylaminomethyl)phenoxy]-N-propylpropanamide
CID 43515713
2-[2,4-dichloro-6-(hydroxymethyl)phenoxy]-N-pentylpropanamide
CID 43516286
2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]pentanoic acid
CID 83037579
2-[2-(aminomethyl)-4,6-dichlorophenoxy]-N-prop-2-enylpropanamide
CID 60890212
2-[2-(2-aminopropyl)-4,6-dichlorophenoxy]-N-methylpropanamide
CID 54928907
methyl 2-[2-[(tert-butylamino)methyl]-4,6-dichlorophenoxy]propanoate
CID 63058119
2-[2-(2-aminoethyl)-6-chlorophenoxy]-N-ethylpropanamide
CID 112615083
N-[[3,5-dichloro-2-(2,2-difluoroethoxy)phenyl]methyl]ethanamine
CID 54939665
2-(2,4-dichloro-6-formylphenoxy)-N-prop-2-ynylpropanamide
CID 43515928

Frequently Asked Questions

What is the IUPAC name of 2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide?
The IUPAC name of 2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide (CID 43515771) is 2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide.
What is the SMILES notation for 2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide?
The canonical SMILES for 2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide is CCNCc1cc(Cl)cc(Cl)c1OC(C)C(=O)NCC.
What is the InChIKey of 2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide?
The InChIKey is CBHHGYRCUGYUOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20Cl2N2O2/c1-4-17-8-10-6-11(15)7-12(16)13(10)20-9(3)14(19)18-5-2/h6-7,9,17H,4-5,8H2,1-3H3,(H,18,19).
What are the key properties of 2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide?
2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide has a molecular weight of 319.23 g/mol, XLogP of 3.01, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]-N-ethylpropanamide is sourced from PubChem (CID 43515771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).