2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide

C19H20Cl2FNO2 — CID 71229566

IUPAC2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide
SMILESCC(Oc1ccc(Cl)cc1Cl)C(=O)NC(c1ccc(F)cc1)C(C)C
InChIInChI=1S/C19H20Cl2FNO2/c1-11(2)18(13-4-7-15(22)8-5-13)23-19(24)12(3)25-17-9-6-14(20)10-16(17)21/h4-12,18H,1-3H3,(H,23,24)
InChIKeyNVYPCXKNAGZZNJ-UHFFFAOYSA-N
MW384.28 g/mol
LogP5.41
Rot. Bonds6

About 2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide

2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide (PubChem CID 71229566) has the molecular formula C19H20Cl2FNO2 and a molecular weight of 384.28 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide
PubChem CID71229566
Molecular FormulaC19H20Cl2FNO2
Molecular Weight384.28 g/mol
Exact Mass383.09
IUPAC Name2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide
SMILESCC(Oc1ccc(Cl)cc1Cl)C(=O)NC(c1ccc(F)cc1)C(C)C
InChIInChI=1S/C19H20Cl2FNO2/c1-11(2)18(13-4-7-15(22)8-5-13)23-19(24)12(3)25-17-9-6-14(20)10-16(17)21/h4-12,18H,1-3H3,(H,23,24)
InChIKeyNVYPCXKNAGZZNJ-UHFFFAOYSA-N
XLogP5.41
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.28
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-2-(4-chlorophenoxy)acetamide
CID 2791617
N-benzyl-2-(2-chlorophenoxy)acetamide
CID 707236
2-(2-chlorophenoxy)-N-(1-phenylethyl)acetamide
CID 2787215
N-[2-(1-cyclohexen-1-yl)ethyl]-2-(2,4-dichlorophenoxy)propanamide
CID 2899212
N-[3-(4-chlorophenyl)-1-methyl-2-phenylpropyl]-2-(4-chlorophenyloxy)-2-methylpropanamide
CID 9868656
N-[2,3-bis(4-chlorophenyl)-1-methylpropyl]-2-(4-chlorophenyloxy)-2-methylpropanamide
CID 10195774
N-(3-chlorobenzyl)-2-(2-chlorophenoxy)-N-((R)-pyrrolidin-2-ylmethyl)propanamide
CID 44579802
N-[2-(1-cyclohexen-1-yl)ethyl]-2-(2,4-dichlorophenoxy)acetamide
CID 695016
2-(2,4-dichlorophenoxy)-N-(4-phenylbutyl)acetamide
CID 2218265
[2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl] 4-(2,4-dichlorophenoxy)butanoate
CID 2407942
2-(2-chloro-4-fluorophenoxy)-N-[(4-hydroxy-3,5-dimethylphenyl)methyl]acetamide
CID 2539740
4-(4-chlorophenoxy)-N-(1-phenylethyl)butanamide
CID 2790654

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide (CID 71229566) is 2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide is CC(Oc1ccc(Cl)cc1Cl)C(=O)NC(c1ccc(F)cc1)C(C)C.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide?
The InChIKey is NVYPCXKNAGZZNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2FNO2/c1-11(2)18(13-4-7-15(22)8-5-13)23-19(24)12(3)25-17-9-6-14(20)10-16(17)21/h4-12,18H,1-3H3,(H,23,24).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide?
2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide has a molecular weight of 384.28 g/mol, XLogP of 5.41, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]propanamide is sourced from PubChem (CID 71229566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).