2-(4-bromophenoxy)-N-cyclopropylacetamide

C11H12BrNO2 — CID 2631886

IUPAC2-(4-bromophenoxy)-N-cyclopropylacetamide
SMILESO=C(COc1ccc(Br)cc1)NC1CC1
InChIInChI=1S/C11H12BrNO2/c12-8-1-5-10(6-2-8)15-7-11(14)13-9-3-4-9/h1-2,5-6,9H,3-4,7H2,(H,13,14)
InChIKeyGHTGQVVWVKOAQI-UHFFFAOYSA-N
MW270.13 g/mol
LogP2.11
Rot. Bonds4

About 2-(4-bromophenoxy)-N-cyclopropylacetamide

2-(4-bromophenoxy)-N-cyclopropylacetamide (PubChem CID 2631886) has the molecular formula C11H12BrNO2 and a molecular weight of 270.13 g/mol. Its IUPAC name is 2-(4-bromophenoxy)-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-(4-bromophenoxy)-N-cyclopropylacetamide
PubChem CID2631886
Molecular FormulaC11H12BrNO2
Molecular Weight270.13 g/mol
Exact Mass269.01
IUPAC Name2-(4-bromophenoxy)-N-cyclopropylacetamide
SMILESO=C(COc1ccc(Br)cc1)NC1CC1
InChIInChI=1S/C11H12BrNO2/c12-8-1-5-10(6-2-8)15-7-11(14)13-9-3-4-9/h1-2,5-6,9H,3-4,7H2,(H,13,14)
InChIKeyGHTGQVVWVKOAQI-UHFFFAOYSA-N
XLogP2.11
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.13
LogP ≤ 52.11
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-Bromophenoxy)-1-morpholin-4-ylethanone
CID 674921
2-(4-bromo-2-methylphenoxy)-N-cyclopentylacetamide
CID 803345
[2-(Cyclopentylamino)-2-oxoethyl] 2-(4-bromophenoxy)acetate
CID 2376778
2-(4-bromo-2-fluorophenoxy)-N-cyclopropylacetamide
CID 2523046
1-[2-(4-Bromophenoxy)acetyl]imidazolidin-2-one
CID 5299798
2-(4-Bromophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone
CID 6467438
(S)-2-(4-bromophenoxy)-N-(2-oxotetrahydrofuran-3-yl)acetamide
CID 44581696
N-cyclopropyl-2-(4-fluorophenoxy)acetamide
CID 653897
2-(2-bromophenoxy)-N-cyclopentylacetamide
CID 729424
N-cyclopropyl-2-(2-fluorophenoxy)acetamide
CID 1294449

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenoxy)-N-cyclopropylacetamide?
The IUPAC name of 2-(4-bromophenoxy)-N-cyclopropylacetamide (CID 2631886) is 2-(4-bromophenoxy)-N-cyclopropylacetamide.
What is the SMILES notation for 2-(4-bromophenoxy)-N-cyclopropylacetamide?
The canonical SMILES for 2-(4-bromophenoxy)-N-cyclopropylacetamide is O=C(COc1ccc(Br)cc1)NC1CC1.
What is the InChIKey of 2-(4-bromophenoxy)-N-cyclopropylacetamide?
The InChIKey is GHTGQVVWVKOAQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12BrNO2/c12-8-1-5-10(6-2-8)15-7-11(14)13-9-3-4-9/h1-2,5-6,9H,3-4,7H2,(H,13,14).
What are the key properties of 2-(4-bromophenoxy)-N-cyclopropylacetamide?
2-(4-bromophenoxy)-N-cyclopropylacetamide has a molecular weight of 270.13 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenoxy)-N-cyclopropylacetamide is sourced from PubChem (CID 2631886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).