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

C16H14BrClFNO — CID 8759773

IUPACN-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide
SMILESC[C@@H](NC(=O)Cc1c(F)cccc1Cl)c1ccccc1Br
InChIInChI=1S/C16H14BrClFNO/c1-10(11-5-2-3-6-13(11)17)20-16(21)9-12-14(18)7-4-8-15(12)19/h2-8,10H,9H2,1H3,(H,20,21)/t10-/m1/s1
InChIKeyWAYLEZGJVBPRJS-SNVBAGLBSA-N
MW370.65 g/mol
LogP4.66
Rot. Bonds4

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

N-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide (PubChem CID 8759773) has the molecular formula C16H14BrClFNO and a molecular weight of 370.65 g/mol. Its IUPAC name is N-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide
PubChem CID8759773
Molecular FormulaC16H14BrClFNO
Molecular Weight370.65 g/mol
Exact Mass368.99
IUPAC NameN-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide
SMILESC[C@@H](NC(=O)Cc1c(F)cccc1Cl)c1ccccc1Br
InChIInChI=1S/C16H14BrClFNO/c1-10(11-5-2-3-6-13(11)17)20-16(21)9-12-14(18)7-4-8-15(12)19/h2-8,10H,9H2,1H3,(H,20,21)/t10-/m1/s1
InChIKeyWAYLEZGJVBPRJS-SNVBAGLBSA-N
XLogP4.66
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.65
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide?
The IUPAC name of N-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide (CID 8759773) is N-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide.
What is the SMILES notation for N-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide?
The canonical SMILES for N-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide is C[C@@H](NC(=O)Cc1c(F)cccc1Cl)c1ccccc1Br.
What is the InChIKey of N-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide?
The InChIKey is WAYLEZGJVBPRJS-SNVBAGLBSA-N. The full InChI is InChI=1S/C16H14BrClFNO/c1-10(11-5-2-3-6-13(11)17)20-16(21)9-12-14(18)7-4-8-15(12)19/h2-8,10H,9H2,1H3,(H,20,21)/t10-/m1/s1.
What are the key properties of N-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide?
N-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide has a molecular weight of 370.65 g/mol, XLogP of 4.66, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(2-bromophenyl)ethyl]-2-(2-chloro-6-fluorophenyl)acetamide is sourced from PubChem (CID 8759773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).