(2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide

C16H15ClFNO2 — CID 26529991

IUPAC(2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide
SMILESCc1ccc(O[C@H](C)C(=O)Nc2ccc(Cl)cc2F)cc1
InChIInChI=1S/C16H15ClFNO2/c1-10-3-6-13(7-4-10)21-11(2)16(20)19-15-8-5-12(17)9-14(15)18/h3-9,11H,1-2H3,(H,19,20)/t11-/m1/s1
InChIKeyWKTIQLKEFGYTLN-LLVKDONJSA-N
MW307.75 g/mol
LogP4.19
Rot. Bonds4

About (2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide

(2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide (PubChem CID 26529991) has the molecular formula C16H15ClFNO2 and a molecular weight of 307.75 g/mol. Its IUPAC name is (2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide
PubChem CID26529991
Molecular FormulaC16H15ClFNO2
Molecular Weight307.75 g/mol
Exact Mass307.08
IUPAC Name(2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide
SMILESCc1ccc(O[C@H](C)C(=O)Nc2ccc(Cl)cc2F)cc1
InChIInChI=1S/C16H15ClFNO2/c1-10-3-6-13(7-4-10)21-11(2)16(20)19-15-8-5-12(17)9-14(15)18/h3-9,11H,1-2H3,(H,19,20)/t11-/m1/s1
InChIKeyWKTIQLKEFGYTLN-LLVKDONJSA-N
XLogP4.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.75
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-(4-chloro-2-fluorophenyl)-2-(4-fluorophenoxy)propanamide
CID 7961263
(2R)-N-(5-chloro-2-methylphenyl)-2-(4-methylphenoxy)propanamide
CID 837813
(2S)-N-(4-chloro-2-fluorophenyl)-2-(3-methyl-4-nitrophenoxy)propanamide
CID 9384236
(2S)-N-(4-bromo-2-fluorophenyl)-2-(4-chlorophenoxy)propanamide
CID 7959134
2-(4-chlorophenoxy)-N-(2-hydroxy-4-methylphenyl)propanamide
CID 51166464
(2R)-2-(3-acetylphenoxy)-N-(4-chloro-2-fluorophenyl)propanamide
CID 8639705
(2R)-2-(4-methylphenoxy)-N-(2,4,5-trichlorophenyl)propanamide
CID 7372209
N-(2-bromo-4-methylphenyl)-2-(3,4-difluorophenoxy)propanamide
CID 55424008
2-(4-chlorophenoxy)-N-(4-methylphenyl)propanamide
CID 4943921
N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide
CID 19191556
N-(4-bromo-2-fluorophenyl)-2-(4-bromophenoxy)propanamide
CID 18084152
(2R)-N-(2-hydroxy-4-methylphenyl)-2-(4-methylphenoxy)propanamide
CID 92534084

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide?
The IUPAC name of (2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide (CID 26529991) is (2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide.
What is the SMILES notation for (2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide?
The canonical SMILES for (2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide is Cc1ccc(O[C@H](C)C(=O)Nc2ccc(Cl)cc2F)cc1.
What is the InChIKey of (2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide?
The InChIKey is WKTIQLKEFGYTLN-LLVKDONJSA-N. The full InChI is InChI=1S/C16H15ClFNO2/c1-10-3-6-13(7-4-10)21-11(2)16(20)19-15-8-5-12(17)9-14(15)18/h3-9,11H,1-2H3,(H,19,20)/t11-/m1/s1.
What are the key properties of (2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide?
(2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide has a molecular weight of 307.75 g/mol, XLogP of 4.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide is sourced from PubChem (CID 26529991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).