2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide

C15H20BrNO3 — CID 102866038

IUPAC2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide
SMILESO=C(COc1ccc(Br)cc1)N(CCCO)C1CCC1
InChIInChI=1S/C15H20BrNO3/c16-12-5-7-14(8-6-12)20-11-15(19)17(9-2-10-18)13-3-1-4-13/h5-8,13,18H,1-4,9-11H2
InChIKeyFENUMAPILBTLIZ-UHFFFAOYSA-N
MW342.23 g/mol
LogP2.59
Rot. Bonds7

About 2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide

2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide (PubChem CID 102866038) has the molecular formula C15H20BrNO3 and a molecular weight of 342.23 g/mol. Its IUPAC name is 2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide.

Molecular Properties

Compound Name2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide
PubChem CID102866038
Molecular FormulaC15H20BrNO3
Molecular Weight342.23 g/mol
Exact Mass341.06
IUPAC Name2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide
SMILESO=C(COc1ccc(Br)cc1)N(CCCO)C1CCC1
InChIInChI=1S/C15H20BrNO3/c16-12-5-7-14(8-6-12)20-11-15(19)17(9-2-10-18)13-3-1-4-13/h5-8,13,18H,1-4,9-11H2
InChIKeyFENUMAPILBTLIZ-UHFFFAOYSA-N
XLogP2.59
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.23
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-bromophenoxy)-N-cyclobutyl-N-(2-hydroxyethyl)propanamide
CID 102684243
N-cyclobutyl-N-(2-hydroxyethyl)-2-phenoxyacetamide
CID 102684381
4-(4-bromophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)butanamide
CID 43576564
2-(4-bromophenoxy)-N-cycloheptyl-N-methylacetamide
CID 55469833
2-(4-bromophenoxy)-N-cyclohexyl-N-methylacetamide
CID 46771197
N-(3-aminopropyl)-N-cyclohexyl-2-phenoxyacetamide
CID 43319389
N-cyclobutyl-2-(2,4-difluorophenoxy)-N-(3-hydroxypropyl)acetamide
CID 102866483
N-(2-chloroethyl)-N-cyclobutyl-2-phenoxyacetamide
CID 102872589
N-cyclobutyl-N-(3-hydroxypropyl)-2-methoxyacetamide
CID 102866415
N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide
CID 43136742
4-bromo-N-cyclobutyl-N-(3-hydroxypropyl)-2-sulfanylbenzamide
CID 107036757
2-amino-5-bromo-N-cyclobutyl-N-(3-hydroxypropyl)benzamide
CID 102864994

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide?
The IUPAC name of 2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide (CID 102866038) is 2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide.
What is the SMILES notation for 2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide?
The canonical SMILES for 2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide is O=C(COc1ccc(Br)cc1)N(CCCO)C1CCC1.
What is the InChIKey of 2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide?
The InChIKey is FENUMAPILBTLIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20BrNO3/c16-12-5-7-14(8-6-12)20-11-15(19)17(9-2-10-18)13-3-1-4-13/h5-8,13,18H,1-4,9-11H2.
What are the key properties of 2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide?
2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide has a molecular weight of 342.23 g/mol, XLogP of 2.59, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide is sourced from PubChem (CID 102866038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).