2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide

C14H14BrNO3 — CID 17173386

IUPAC2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide
SMILESCC(Oc1ccccc1Br)C(=O)NCc1ccco1
InChIInChI=1S/C14H14BrNO3/c1-10(19-13-7-3-2-6-12(13)15)14(17)16-9-11-5-4-8-18-11/h2-8,10H,9H2,1H3,(H,16,17)
InChIKeyKUHPJOUBQBDDLJ-UHFFFAOYSA-N
MW324.17 g/mol
LogP3.13
Rot. Bonds5

About 2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide

2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide (PubChem CID 17173386) has the molecular formula C14H14BrNO3 and a molecular weight of 324.17 g/mol. Its IUPAC name is 2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide
PubChem CID17173386
Molecular FormulaC14H14BrNO3
Molecular Weight324.17 g/mol
Exact Mass323.02
IUPAC Name2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide
SMILESCC(Oc1ccccc1Br)C(=O)NCc1ccco1
InChIInChI=1S/C14H14BrNO3/c1-10(19-13-7-3-2-6-12(13)15)14(17)16-9-11-5-4-8-18-11/h2-8,10H,9H2,1H3,(H,16,17)
InChIKeyKUHPJOUBQBDDLJ-UHFFFAOYSA-N
XLogP3.13
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.17
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-bromo-4-methoxyphenoxy)-N-(furan-2-ylmethyl)propanamide
CID 104707302
(2S)-2-(2-acetamidophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 9116644
N-(furan-2-ylmethyl)-2-(2-nitrophenoxy)propanamide
CID 4943832
2-(4-bromo-2-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 2970667
(2S)-2-(4-fluorophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 26909573
N-(furan-2-ylmethyl)-2-quinolin-8-yloxypropanamide
CID 4781245
2-(2-bromophenoxy)-N-[2-(methylamino)ethyl]propanamide;hydrochloride
CID 119502634
N-(2-aminoethyl)-2-(2-bromophenoxy)propanamide;hydrochloride
CID 119384173
2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 62304320
2-(3-chloro-2-cyanophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 114322470
2-(4-chloro-3,5-dimethylphenoxy)-N-(furan-2-ylmethyl)propanamide
CID 19191627
(2R)-N-(furan-2-ylmethyl)-2-[(2-nitro-3-pyridinyl)oxy]propanamide
CID 40662422

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide?
The IUPAC name of 2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide (CID 17173386) is 2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide.
What is the SMILES notation for 2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide?
The canonical SMILES for 2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide is CC(Oc1ccccc1Br)C(=O)NCc1ccco1.
What is the InChIKey of 2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide?
The InChIKey is KUHPJOUBQBDDLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO3/c1-10(19-13-7-3-2-6-12(13)15)14(17)16-9-11-5-4-8-18-11/h2-8,10H,9H2,1H3,(H,16,17).
What are the key properties of 2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide?
2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide has a molecular weight of 324.17 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide is sourced from PubChem (CID 17173386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).