(2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide

C17H17ClFNO4 — CID 31966341

IUPAC(2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide
SMILESCOc1cc(OC)c(NC(=O)[C@@H](C)Oc2ccccc2F)cc1Cl
InChIInChI=1S/C17H17ClFNO4/c1-10(24-14-7-5-4-6-12(14)19)17(21)20-13-8-11(18)15(22-2)9-16(13)23-3/h4-10H,1-3H3,(H,20,21)/t10-/m1/s1
InChIKeyWOXBCCUYWDHXGJ-SNVBAGLBSA-N
MW353.78 g/mol
LogP3.90
Rot. Bonds6

About (2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide

(2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide (PubChem CID 31966341) has the molecular formula C17H17ClFNO4 and a molecular weight of 353.78 g/mol. Its IUPAC name is (2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide
PubChem CID31966341
Molecular FormulaC17H17ClFNO4
Molecular Weight353.78 g/mol
Exact Mass353.08
IUPAC Name(2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide
SMILESCOc1cc(OC)c(NC(=O)[C@@H](C)Oc2ccccc2F)cc1Cl
InChIInChI=1S/C17H17ClFNO4/c1-10(24-14-7-5-4-6-12(14)19)17(21)20-13-8-11(18)15(22-2)9-16(13)23-3/h4-10H,1-3H3,(H,20,21)/t10-/m1/s1
InChIKeyWOXBCCUYWDHXGJ-SNVBAGLBSA-N
XLogP3.90
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.78
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide
CID 3318555
(2S)-N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-methoxyphenoxy)propanamide
CID 9181052
(2R)-N-(2,4-dichlorophenyl)-2-(2-fluorophenoxy)propanamide
CID 7815023
N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide
CID 43905902
(2R)-N-(2-chloro-4-fluorophenyl)-2-(2-methoxyphenoxy)propanamide
CID 7834392
(2S)-N-(2-chloro-4-fluorophenyl)-2-(2-methoxyphenoxy)propanamide
CID 7834391
(2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 7815222
(2S)-N-(4-chloro-2,5-dimethoxyphenyl)-2-(2,3-dimethylphenoxy)propanamide
CID 38916474
N-(4-chloro-2,5-dimethoxyphenyl)-2-(2,3-dimethylphenoxy)propanamide
CID 46771651
N-(2,5-difluorophenyl)-2-(2-fluorophenoxy)propanamide
CID 86909512
2-(4-bromophenoxy)-N-(5-chloro-2,4-dimethoxyphenyl)propanamide
CID 2953802
(2S)-2-(2,5-dichlorophenoxy)-N-(2-fluorophenyl)propanamide
CID 7269908

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide?
The IUPAC name of (2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide (CID 31966341) is (2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide.
What is the SMILES notation for (2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide?
The canonical SMILES for (2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide is COc1cc(OC)c(NC(=O)[C@@H](C)Oc2ccccc2F)cc1Cl.
What is the InChIKey of (2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide?
The InChIKey is WOXBCCUYWDHXGJ-SNVBAGLBSA-N. The full InChI is InChI=1S/C17H17ClFNO4/c1-10(24-14-7-5-4-6-12(14)19)17(21)20-13-8-11(18)15(22-2)9-16(13)23-3/h4-10H,1-3H3,(H,20,21)/t10-/m1/s1.
What are the key properties of (2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide?
(2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide has a molecular weight of 353.78 g/mol, XLogP of 3.90, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide is sourced from PubChem (CID 31966341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).