2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide

C14H19Cl2NO3 — CID 115771866

IUPAC2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide
SMILESCCN(CCCO)C(=O)C(C)Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H19Cl2NO3/c1-3-17(7-4-8-18)14(19)10(2)20-13-6-5-11(15)9-12(13)16/h5-6,9-10,18H,3-4,7-8H2,1-2H3
InChIKeyRMAHOZSNGYWVGL-UHFFFAOYSA-N
MW320.22 g/mol
LogP2.99
Rot. Bonds7

About 2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide

2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide (PubChem CID 115771866) has the molecular formula C14H19Cl2NO3 and a molecular weight of 320.22 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide
PubChem CID115771866
Molecular FormulaC14H19Cl2NO3
Molecular Weight320.22 g/mol
Exact Mass319.07
IUPAC Name2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide
SMILESCCN(CCCO)C(=O)C(C)Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H19Cl2NO3/c1-3-17(7-4-8-18)14(19)10(2)20-13-6-5-11(15)9-12(13)16/h5-6,9-10,18H,3-4,7-8H2,1-2H3
InChIKeyRMAHOZSNGYWVGL-UHFFFAOYSA-N
XLogP2.99
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.22
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dibutyl-2-(2,4-dichlorophenoxy)propanamide
CID 4155805
N,N-di(butan-2-yl)-2-(2,4-dichlorophenoxy)propanamide
CID 4617435
2-(2,5-dimethylphenoxy)-N-ethyl-N-(4-hydroxybutyl)propanamide
CID 46997752
N-cyclobutyl-2-(2,4-dichlorophenoxy)-N-(2-hydroxyethyl)propanamide
CID 102684163
2-(2,4-dichlorophenoxy)-N-[2-oxo-2-(propylamino)ethyl]-N-propylpropanamide
CID 60535069
N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide
CID 115771406
2-(2,4-dichlorophenoxy)-N-(4-hydroxyphenyl)-N-methylpropanamide
CID 82032140
2-(2,4-dichlorophenoxy)propanoyl chloride
CID 14303380
2-(2,4-dichlorophenoxy)propanoic acid
CID 8427
2-(2,4-dichlorophenoxy)-N-dodecylpropanamide
CID 4582803
2-(2,4-dichlorophenoxy)-N-nonylpropanamide
CID 4130170
azane;2-(2,4-dichlorophenoxy)propanoic acid
CID 173303839

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide (CID 115771866) is 2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide is CCN(CCCO)C(=O)C(C)Oc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide?
The InChIKey is RMAHOZSNGYWVGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19Cl2NO3/c1-3-17(7-4-8-18)14(19)10(2)20-13-6-5-11(15)9-12(13)16/h5-6,9-10,18H,3-4,7-8H2,1-2H3.
What are the key properties of 2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide?
2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide has a molecular weight of 320.22 g/mol, XLogP of 2.99, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-ethyl-N-(3-hydroxypropyl)propanamide is sourced from PubChem (CID 115771866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).