2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide

C16H15ClFNO — CID 839132

IUPAC2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide
SMILESC[C@@H](NC(=O)Cc1c(F)cccc1Cl)c1ccccc1
InChIInChI=1S/C16H15ClFNO/c1-11(12-6-3-2-4-7-12)19-16(20)10-13-14(17)8-5-9-15(13)18/h2-9,11H,10H2,1H3,(H,19,20)/t11-/m1/s1
InChIKeyVQMPHAMCBLZNSV-LLVKDONJSA-N
MW291.75 g/mol
LogP3.90
Rot. Bonds4

About 2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide

2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide (PubChem CID 839132) has the molecular formula C16H15ClFNO and a molecular weight of 291.75 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide
PubChem CID839132
Molecular FormulaC16H15ClFNO
Molecular Weight291.75 g/mol
Exact Mass291.08
IUPAC Name2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide
SMILESC[C@@H](NC(=O)Cc1c(F)cccc1Cl)c1ccccc1
InChIInChI=1S/C16H15ClFNO/c1-11(12-6-3-2-4-7-12)19-16(20)10-13-14(17)8-5-9-15(13)18/h2-9,11H,10H2,1H3,(H,19,20)/t11-/m1/s1
InChIKeyVQMPHAMCBLZNSV-LLVKDONJSA-N
XLogP3.90
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.75
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-chloro-6-fluorophenyl)-N-[1-(3-chlorophenyl)ethyl]acetamide
CID 42998538
[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-(2-chloro-6-fluorophenyl)acetate
CID 2435833
N-[1-(3-aminophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide
CID 43297617
2-(2-chloro-6-fluorophenyl)-N-[1-[4-(trifluoromethoxy)phenyl]ethyl]acetamide
CID 55611461
2-(2-chloro-6-fluorophenyl)-N-[(2R)-4-phenylbutan-2-yl]acetamide
CID 2575385
2-(2-chloro-6-fluorophenyl)-N-[(2S)-4-phenylbutan-2-yl]acetamide
CID 2575382
2-(2-chloro-6-fluorophenyl)-N-[1-(2,5-difluorophenyl)ethyl]acetamide
CID 46588092
[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethyl] 2-(2-chloro-6-fluorophenyl)acetate
CID 7718405
N-[(2S)-1-aminopropan-2-yl]-2-(2-chloro-6-fluorophenyl)acetamide;hydrochloride
CID 120505968
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide
CID 9366156
2-(2-chloro-6-fluorophenyl)-N-[1-(3-methoxy-4-propan-2-yloxyphenyl)ethyl]acetamide
CID 55653646
2-(2-chloro-6-fluorophenyl)-N-(1-methoxypropan-2-yl)acetamide
CID 3437888

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide (CID 839132) is 2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide is C[C@@H](NC(=O)Cc1c(F)cccc1Cl)c1ccccc1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide?
The InChIKey is VQMPHAMCBLZNSV-LLVKDONJSA-N. The full InChI is InChI=1S/C16H15ClFNO/c1-11(12-6-3-2-4-7-12)19-16(20)10-13-14(17)8-5-9-15(13)18/h2-9,11H,10H2,1H3,(H,19,20)/t11-/m1/s1.
What are the key properties of 2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide?
2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide has a molecular weight of 291.75 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide is sourced from PubChem (CID 839132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).