(2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide

C22H17ClN2O2 — CID 7561215

IUPAC(2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide
SMILESC[C@@H](Oc1ccc(-c2ccccc2)cc1Cl)C(=O)Nc1ccc(C#N)cc1
InChIInChI=1S/C22H17ClN2O2/c1-15(22(26)25-19-10-7-16(14-24)8-11-19)27-21-12-9-18(13-20(21)23)17-5-3-2-4-6-17/h2-13,15H,1H3,(H,25,26)/t15-/m1/s1
InChIKeyTYEAUAVBNZBUNG-OAHLLOKOSA-N
MW376.84 g/mol
LogP5.28
Rot. Bonds5

About (2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide

(2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide (PubChem CID 7561215) has the molecular formula C22H17ClN2O2 and a molecular weight of 376.84 g/mol. Its IUPAC name is (2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide
PubChem CID7561215
Molecular FormulaC22H17ClN2O2
Molecular Weight376.84 g/mol
Exact Mass376.10
IUPAC Name(2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide
SMILESC[C@@H](Oc1ccc(-c2ccccc2)cc1Cl)C(=O)Nc1ccc(C#N)cc1
InChIInChI=1S/C22H17ClN2O2/c1-15(22(26)25-19-10-7-16(14-24)8-11-19)27-21-12-9-18(13-20(21)23)17-5-3-2-4-6-17/h2-13,15H,1H3,(H,25,26)/t15-/m1/s1
InChIKeyTYEAUAVBNZBUNG-OAHLLOKOSA-N
XLogP5.28
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.84
LogP ≤ 55.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(2-chloro-4-cyanophenoxy)-N-(4-cyanophenyl)propanamide
CID 8976802
(2S)-2-(2-chloro-4-cyanophenoxy)-N-(4-methylphenyl)propanamide
CID 8976528
(2R)-N-(4-bromophenyl)-2-(2-chloro-4-cyanophenoxy)propanamide
CID 8976471
N-(4-cyanophenyl)-2-(2,3-dichlorophenoxy)propanamide
CID 42990430
(2S)-2-(2-chloro-4-cyanophenoxy)-N-(3-chloro-4-fluorophenyl)propanamide
CID 9383960
(2R)-2-(2-chloro-4-cyanophenoxy)-N-(3-methylphenyl)propanamide
CID 8976723
2-(2-chloro-4-cyanophenoxy)-N-methylpropanamide
CID 60667353
N-[3-chloro-4-(difluoromethoxy)phenyl]-2-(4-cyanophenoxy)propanamide
CID 42902010
(2S)-N-(4-cyanophenyl)-2-(3,4-dichlorophenoxy)propanamide
CID 7433052
N-(3-chloro-4-methoxyphenyl)-2-(4-cyano-2-methoxyphenoxy)propanamide
CID 55422385
(2R)-2-(2-chloro-4-cyanophenoxy)-N-(3-fluoro-4-methylphenyl)propanamide
CID 9383986
N-[4-[2-(2-chlorophenoxy)propanoylamino]phenyl]-4-phenylbenzamide
CID 43887670

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide?
The IUPAC name of (2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide (CID 7561215) is (2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide.
What is the SMILES notation for (2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide?
The canonical SMILES for (2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide is C[C@@H](Oc1ccc(-c2ccccc2)cc1Cl)C(=O)Nc1ccc(C#N)cc1.
What is the InChIKey of (2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide?
The InChIKey is TYEAUAVBNZBUNG-OAHLLOKOSA-N. The full InChI is InChI=1S/C22H17ClN2O2/c1-15(22(26)25-19-10-7-16(14-24)8-11-19)27-21-12-9-18(13-20(21)23)17-5-3-2-4-6-17/h2-13,15H,1H3,(H,25,26)/t15-/m1/s1.
What are the key properties of (2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide?
(2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide has a molecular weight of 376.84 g/mol, XLogP of 5.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-chloro-4-phenylphenoxy)-N-(4-cyanophenyl)propanamide is sourced from PubChem (CID 7561215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).