(2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide

C18H16Cl2N2O2 — CID 9246467

IUPAC(2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide
SMILESC[C@@H](Oc1ccc(C#N)cc1)C(=O)NCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C18H16Cl2N2O2/c1-12(24-16-6-2-13(11-21)3-7-16)18(23)22-9-8-14-4-5-15(19)10-17(14)20/h2-7,10,12H,8-9H2,1H3,(H,22,23)/t12-/m1/s1
InChIKeyOEXFEMUFYLRABE-GFCCVEGCSA-N
MW363.24 g/mol
LogP3.99
Rot. Bonds6

About (2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide

(2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide (PubChem CID 9246467) has the molecular formula C18H16Cl2N2O2 and a molecular weight of 363.24 g/mol. Its IUPAC name is (2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide.

Molecular Properties

Compound Name(2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide
PubChem CID9246467
Molecular FormulaC18H16Cl2N2O2
Molecular Weight363.24 g/mol
Exact Mass362.06
IUPAC Name(2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide
SMILESC[C@@H](Oc1ccc(C#N)cc1)C(=O)NCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C18H16Cl2N2O2/c1-12(24-16-6-2-13(11-21)3-7-16)18(23)22-9-8-14-4-5-15(19)10-17(14)20/h2-7,10,12H,8-9H2,1H3,(H,22,23)/t12-/m1/s1
InChIKeyOEXFEMUFYLRABE-GFCCVEGCSA-N
XLogP3.99
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.24
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2,4-dichlorophenyl)methyl]-2-(4-methoxyphenoxy)propanamide
CID 21173910
N-(5-chloro-2-fluorophenyl)-2-(4-cyanophenoxy)propanamide
CID 16548334
(2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide
CID 9173663
4-[2-(4-cyanophenoxy)propanoylamino]-2-hydroxybutanoic acid
CID 107832580
(2R)-2-(4-cyanophenoxy)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 27645064
(2S)-3-[2-(4-cyanophenoxy)propanoylamino]-2-hydroxypropanoic acid
CID 107833675
3-[2-(4-cyanophenoxy)propanoylamino]-2-hydroxypropanoic acid
CID 66167287
(2S)-2-[4-(4-cyanophenyl)phenoxy]-N-(3,5-dichlorophenyl)propanamide
CID 7670178
[2-(2,4-dichloroanilino)-2-oxoethyl] (2S)-2-(4-cyanophenoxy)propanoate
CID 7984198
(2R)-2-amino-N-[2-(2,4-dichlorophenyl)ethyl]propanamide;hydrochloride
CID 119263879
2-(4-cyanophenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide
CID 51157171
2-cyano-N-[2-(2,4-dichlorophenyl)ethyl]-3,3-dimethylbutanamide
CID 68726093

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide?
The IUPAC name of (2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide (CID 9246467) is (2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide.
What is the SMILES notation for (2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide?
The canonical SMILES for (2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide is C[C@@H](Oc1ccc(C#N)cc1)C(=O)NCCc1ccc(Cl)cc1Cl.
What is the InChIKey of (2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide?
The InChIKey is OEXFEMUFYLRABE-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H16Cl2N2O2/c1-12(24-16-6-2-13(11-21)3-7-16)18(23)22-9-8-14-4-5-15(19)10-17(14)20/h2-7,10,12H,8-9H2,1H3,(H,22,23)/t12-/m1/s1.
What are the key properties of (2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide?
(2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide has a molecular weight of 363.24 g/mol, XLogP of 3.99, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide is sourced from PubChem (CID 9246467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).