2-(2-bromophenoxy)-N-cyclopentylacetamide

C13H16BrNO2 — CID 729424

IUPAC2-(2-bromophenoxy)-N-cyclopentylacetamide
SMILESO=C(COc1ccccc1Br)NC1CCCC1
InChIInChI=1S/C13H16BrNO2/c14-11-7-3-4-8-12(11)17-9-13(16)15-10-5-1-2-6-10/h3-4,7-8,10H,1-2,5-6,9H2,(H,15,16)
InChIKeyWPBAJCQPMUCXLP-UHFFFAOYSA-N
MW298.18 g/mol
LogP2.89
Rot. Bonds4

About 2-(2-bromophenoxy)-N-cyclopentylacetamide

2-(2-bromophenoxy)-N-cyclopentylacetamide (PubChem CID 729424) has the molecular formula C13H16BrNO2 and a molecular weight of 298.18 g/mol. Its IUPAC name is 2-(2-bromophenoxy)-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-(2-bromophenoxy)-N-cyclopentylacetamide
PubChem CID729424
Molecular FormulaC13H16BrNO2
Molecular Weight298.18 g/mol
Exact Mass297.04
IUPAC Name2-(2-bromophenoxy)-N-cyclopentylacetamide
SMILESO=C(COc1ccccc1Br)NC1CCCC1
InChIInChI=1S/C13H16BrNO2/c14-11-7-3-4-8-12(11)17-9-13(16)15-10-5-1-2-6-10/h3-4,7-8,10H,1-2,5-6,9H2,(H,15,16)
InChIKeyWPBAJCQPMUCXLP-UHFFFAOYSA-N
XLogP2.89
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.18
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromophenoxy)-N-[2-(1-pyrrolidinyl)ethyl]acetamide
CID 23723164
N-cyclohexyl-2-phenoxyacetamide
CID 832666
2-(4-bromo-2-methylphenoxy)-N-cyclopentylacetamide
CID 803345
[2-(Cyclopentylamino)-2-oxoethyl] 2-(4-bromophenoxy)acetate
CID 2376778
[2-(Cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate
CID 2507035
2-(4-bromo-2-fluorophenoxy)-N-cyclopropylacetamide
CID 2523046
1-[2-(2-Bromophenoxy)acetyl]imidazolidin-2-one
CID 9466285
(S)-2-(4-bromophenoxy)-N-(2-oxotetrahydrofuran-3-yl)acetamide
CID 44581696
2-(4-Bromophenoxy)-1-(4-cyclopentylpiperazin-1-yl)ethanone
CID 1357308
2-(2,4-dibromophenoxy)-N-[oxo-(propan-2-ylamino)methyl]acetamide
CID 2632577
N-(cyclopentylcarbamoyl)-2-(2,4-dibromophenoxy)acetamide
CID 2632678
N-cyclopentyl-2-(2,4-dibromophenoxy)acetamide
CID 2632827

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenoxy)-N-cyclopentylacetamide?
The IUPAC name of 2-(2-bromophenoxy)-N-cyclopentylacetamide (CID 729424) is 2-(2-bromophenoxy)-N-cyclopentylacetamide.
What is the SMILES notation for 2-(2-bromophenoxy)-N-cyclopentylacetamide?
The canonical SMILES for 2-(2-bromophenoxy)-N-cyclopentylacetamide is O=C(COc1ccccc1Br)NC1CCCC1.
What is the InChIKey of 2-(2-bromophenoxy)-N-cyclopentylacetamide?
The InChIKey is WPBAJCQPMUCXLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16BrNO2/c14-11-7-3-4-8-12(11)17-9-13(16)15-10-5-1-2-6-10/h3-4,7-8,10H,1-2,5-6,9H2,(H,15,16).
What are the key properties of 2-(2-bromophenoxy)-N-cyclopentylacetamide?
2-(2-bromophenoxy)-N-cyclopentylacetamide has a molecular weight of 298.18 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenoxy)-N-cyclopentylacetamide is sourced from PubChem (CID 729424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).