2-(4-bromophenyl)-N-cyclohexylacetamide

C14H18BrNO — CID 842496

IUPAC2-(4-bromophenyl)-N-cyclohexylacetamide
SMILESO=C(Cc1ccc(Br)cc1)NC1CCCCC1
InChIInChI=1S/C14H18BrNO/c15-12-8-6-11(7-9-12)10-14(17)16-13-4-2-1-3-5-13/h6-9,13H,1-5,10H2,(H,16,17)
InChIKeyPJOSGGCYLRZVNE-UHFFFAOYSA-N
MW296.21 g/mol
LogP3.44
Rot. Bonds3

About 2-(4-bromophenyl)-N-cyclohexylacetamide

2-(4-bromophenyl)-N-cyclohexylacetamide (PubChem CID 842496) has the molecular formula C14H18BrNO and a molecular weight of 296.21 g/mol. Its IUPAC name is 2-(4-bromophenyl)-N-cyclohexylacetamide.

Molecular Properties

Compound Name2-(4-bromophenyl)-N-cyclohexylacetamide
PubChem CID842496
Molecular FormulaC14H18BrNO
Molecular Weight296.21 g/mol
Exact Mass295.06
IUPAC Name2-(4-bromophenyl)-N-cyclohexylacetamide
SMILESO=C(Cc1ccc(Br)cc1)NC1CCCCC1
InChIInChI=1S/C14H18BrNO/c15-12-8-6-11(7-9-12)10-14(17)16-13-4-2-1-3-5-13/h6-9,13H,1-5,10H2,(H,16,17)
InChIKeyPJOSGGCYLRZVNE-UHFFFAOYSA-N
XLogP3.44
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.21
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-N-cyclohexylacetamide?
The IUPAC name of 2-(4-bromophenyl)-N-cyclohexylacetamide (CID 842496) is 2-(4-bromophenyl)-N-cyclohexylacetamide.
What is the SMILES notation for 2-(4-bromophenyl)-N-cyclohexylacetamide?
The canonical SMILES for 2-(4-bromophenyl)-N-cyclohexylacetamide is O=C(Cc1ccc(Br)cc1)NC1CCCCC1.
What is the InChIKey of 2-(4-bromophenyl)-N-cyclohexylacetamide?
The InChIKey is PJOSGGCYLRZVNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18BrNO/c15-12-8-6-11(7-9-12)10-14(17)16-13-4-2-1-3-5-13/h6-9,13H,1-5,10H2,(H,16,17).
What are the key properties of 2-(4-bromophenyl)-N-cyclohexylacetamide?
2-(4-bromophenyl)-N-cyclohexylacetamide has a molecular weight of 296.21 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-N-cyclohexylacetamide is sourced from PubChem (CID 842496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).