2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide

C15H19F2NO2 — CID 7707055

IUPAC2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide
SMILESC[C@@H]1CCCC[C@@H]1NC(=O)COc1ccc(F)c(F)c1
InChIInChI=1S/C15H19F2NO2/c1-10-4-2-3-5-14(10)18-15(19)9-20-11-6-7-12(16)13(17)8-11/h6-8,10,14H,2-5,9H2,1H3,(H,18,19)/t10-,14+/m1/s1
InChIKeyPAVZWMBFBYWUGC-YGRLFVJLSA-N
MW283.32 g/mol
LogP3.04
Rot. Bonds4

About 2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide

2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide (PubChem CID 7707055) has the molecular formula C15H19F2NO2 and a molecular weight of 283.32 g/mol. Its IUPAC name is 2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide.

Molecular Properties

Compound Name2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide
PubChem CID7707055
Molecular FormulaC15H19F2NO2
Molecular Weight283.32 g/mol
Exact Mass283.14
IUPAC Name2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide
SMILESC[C@@H]1CCCC[C@@H]1NC(=O)COc1ccc(F)c(F)c1
InChIInChI=1S/C15H19F2NO2/c1-10-4-2-3-5-14(10)18-15(19)9-20-11-6-7-12(16)13(17)8-11/h6-8,10,14H,2-5,9H2,1H3,(H,18,19)/t10-,14+/m1/s1
InChIKeyPAVZWMBFBYWUGC-YGRLFVJLSA-N
XLogP3.04
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.32
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S,2S)-2-methylcyclohexyl]-2-naphthalen-2-yloxyacetamide
CID 2517702
N-cyclohexyl-2-(3,4-difluorophenoxy)acetamide
CID 78767908
2-(3-chlorophenoxy)-N-[(1R,2R)-2-methylcyclohexyl]acetamide
CID 2632990
2-(3-chloro-4-fluorophenoxy)-N-[(1R,2R,3R)-2,3-dimethylcyclohexyl]acetamide
CID 11914731
N-[(1R,2R)-2-methylcyclohexyl]-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 8024431
2-(3,5-dimethylphenoxy)-N-[(1R,2S)-2-methylcyclohexyl]acetamide
CID 2712790
2-(3,5-dimethylphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide
CID 2712787
2-(4-bromophenoxy)-N-(2-methylcyclohexyl)acetamide;oxalic acid
CID 171154743
2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide
CID 63277444
2-(3-chlorophenoxy)-N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]acetamide
CID 7818980
2-dibenzofuran-2-yloxy-N-[(1S,2S)-2-methylcyclohexyl]acetamide
CID 7916392
N-(2-methylcyclohexyl)-2-(3-nitrophenoxy)acetamide
CID 18077039

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide?
The IUPAC name of 2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide (CID 7707055) is 2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide.
What is the SMILES notation for 2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide?
The canonical SMILES for 2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide is C[C@@H]1CCCC[C@@H]1NC(=O)COc1ccc(F)c(F)c1.
What is the InChIKey of 2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide?
The InChIKey is PAVZWMBFBYWUGC-YGRLFVJLSA-N. The full InChI is InChI=1S/C15H19F2NO2/c1-10-4-2-3-5-14(10)18-15(19)9-20-11-6-7-12(16)13(17)8-11/h6-8,10,14H,2-5,9H2,1H3,(H,18,19)/t10-,14+/m1/s1.
What are the key properties of 2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide?
2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide has a molecular weight of 283.32 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide is sourced from PubChem (CID 7707055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).