(2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide

C10H7Cl2F4NO2 — CID 7111788

IUPAC(2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide
SMILESCO[C@](F)(C(=O)Nc1c(Cl)cccc1Cl)C(F)(F)F
InChIInChI=1S/C10H7Cl2F4NO2/c1-19-9(13,10(14,15)16)8(18)17-7-5(11)3-2-4-6(7)12/h2-4H,1H3,(H,17,18)/t9-/m1/s1
InChIKeyRNQBUMQKMDGXMX-SECBINFHSA-N
MW320.07 g/mol
LogP3.81
Rot. Bonds3

About (2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide

(2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide (PubChem CID 7111788) has the molecular formula C10H7Cl2F4NO2 and a molecular weight of 320.07 g/mol. Its IUPAC name is (2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide.

Molecular Properties

Compound Name(2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide
PubChem CID7111788
Molecular FormulaC10H7Cl2F4NO2
Molecular Weight320.07 g/mol
Exact Mass318.98
IUPAC Name(2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide
SMILESCO[C@](F)(C(=O)Nc1c(Cl)cccc1Cl)C(F)(F)F
InChIInChI=1S/C10H7Cl2F4NO2/c1-19-9(13,10(14,15)16)8(18)17-7-5(11)3-2-4-6(7)12/h2-4H,1H3,(H,17,18)/t9-/m1/s1
InChIKeyRNQBUMQKMDGXMX-SECBINFHSA-N
XLogP3.81
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.07
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propanamide
CID 163179327
2-chloro-6-[(2,3,3,3-tetrafluoro-2-methoxypropanoyl)amino]benzoic acid
CID 602072
N-(3-chloro-4-fluorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide
CID 2902173
N-(2,6-dichlorophenyl)-2,2,3,3-tetrafluoro-3-(trifluoromethoxy)propanamide
CID 3109818
2-cyano-N-(2,6-dichlorophenyl)-2-methylpropanamide
CID 55208118
2-[[(2R)-2,3,3,3-tetrafluoro-2-methoxypropanoyl]amino]benzoic acid
CID 7111804
2-amino-N-[2-chloro-6-(trifluoromethyl)phenyl]-2-methylpropanamide
CID 61266948
3-[2-chloro-6-(trifluoromethyl)anilino]-2,2-dimethyl-3-oxopropanoic acid
CID 82813361
2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-(2,4,6-trichlorophenyl)propanamide
CID 71672259
N-(2-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
CID 22287271
N-(2,6-dichlorophenyl)-2,6-dimethoxybenzamide
CID 3653582
1-(2,6-dichlorophenyl)-3-methylurea
CID 3018146

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide?
The IUPAC name of (2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide (CID 7111788) is (2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide.
What is the SMILES notation for (2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide?
The canonical SMILES for (2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide is CO[C@](F)(C(=O)Nc1c(Cl)cccc1Cl)C(F)(F)F.
What is the InChIKey of (2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide?
The InChIKey is RNQBUMQKMDGXMX-SECBINFHSA-N. The full InChI is InChI=1S/C10H7Cl2F4NO2/c1-19-9(13,10(14,15)16)8(18)17-7-5(11)3-2-4-6(7)12/h2-4H,1H3,(H,17,18)/t9-/m1/s1.
What are the key properties of (2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide?
(2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide has a molecular weight of 320.07 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2,6-dichlorophenyl)-2,3,3,3-tetrafluoro-2-methoxypropanamide is sourced from PubChem (CID 7111788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).