(2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide

C12H11BrN2O3 — CID 42561678

IUPAC(2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide
SMILESC[C@@H](Oc1ccccc1Br)C(=O)Nc1ccon1
InChIInChI=1S/C12H11BrN2O3/c1-8(12(16)14-11-6-7-17-15-11)18-10-5-3-2-4-9(10)13/h2-8H,1H3,(H,14,15,16)/t8-/m1/s1
InChIKeyBSPUGOKISDSMSK-MRVPVSSYSA-N
MW311.13 g/mol
LogP2.84
Rot. Bonds4

About (2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide

(2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide (PubChem CID 42561678) has the molecular formula C12H11BrN2O3 and a molecular weight of 311.13 g/mol. Its IUPAC name is (2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide.

Molecular Properties

Compound Name(2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide
PubChem CID42561678
Molecular FormulaC12H11BrN2O3
Molecular Weight311.13 g/mol
Exact Mass310.00
IUPAC Name(2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide
SMILESC[C@@H](Oc1ccccc1Br)C(=O)Nc1ccon1
InChIInChI=1S/C12H11BrN2O3/c1-8(12(16)14-11-6-7-17-15-11)18-10-5-3-2-4-9(10)13/h2-8H,1H3,(H,14,15,16)/t8-/m1/s1
InChIKeyBSPUGOKISDSMSK-MRVPVSSYSA-N
XLogP2.84
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.13
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-N-(1,2-oxazol-3-yl)-2-(2-propan-2-ylphenoxy)propanamide
CID 42562928
2-(2,3-dimethylphenoxy)-N-(1,2-oxazol-3-yl)propanamide
CID 17249224
2-(2-bromophenoxy)-N-(5-bromo-2-pyridinyl)propanamide
CID 45147944
(2S)-2-(2-bromophenoxy)-N-phenylpropanamide
CID 7394881
2-(2-bromophenoxy)-N-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
CID 56788300
(2R)-N-(1,2-oxazol-3-yl)-2-(4-propan-2-ylphenoxy)propanamide
CID 42562865
2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide
CID 112777983
2-(2-bromophenoxy)-N-(3-hydroxyphenyl)propanamide
CID 6472883
(2R)-2-(2-bromophenoxy)-N-(3-hydroxyphenyl)propanamide
CID 40639361
(2R)-2-(2-bromophenoxy)-N-(2-fluorophenyl)propanamide
CID 7707082
3-[2-(2-bromophenoxy)propanoylamino]benzoic acid
CID 17341904
4-[2-(2-bromophenoxy)propanoylamino]benzamide
CID 84603766

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide?
The IUPAC name of (2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide (CID 42561678) is (2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide.
What is the SMILES notation for (2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide?
The canonical SMILES for (2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide is C[C@@H](Oc1ccccc1Br)C(=O)Nc1ccon1.
What is the InChIKey of (2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide?
The InChIKey is BSPUGOKISDSMSK-MRVPVSSYSA-N. The full InChI is InChI=1S/C12H11BrN2O3/c1-8(12(16)14-11-6-7-17-15-11)18-10-5-3-2-4-9(10)13/h2-8H,1H3,(H,14,15,16)/t8-/m1/s1.
What are the key properties of (2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide?
(2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide has a molecular weight of 311.13 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-bromophenoxy)-N-(1,2-oxazol-3-yl)propanamide is sourced from PubChem (CID 42561678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).