(2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide

C15H21BrN2O3 — CID 2203701

IUPAC(2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide
SMILESC[C@@H](Oc1ccc(Br)cc1)C(=O)NCCN1CCOCC1
InChIInChI=1S/C15H21BrN2O3/c1-12(21-14-4-2-13(16)3-5-14)15(19)17-6-7-18-8-10-20-11-9-18/h2-5,12H,6-11H2,1H3,(H,17,19)/t12-/m1/s1
InChIKeyVUTSWKPHVFFHQY-GFCCVEGCSA-N
MW357.25 g/mol
LogP1.66
Rot. Bonds6

About (2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide

(2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide (PubChem CID 2203701) has the molecular formula C15H21BrN2O3 and a molecular weight of 357.25 g/mol. Its IUPAC name is (2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide
PubChem CID2203701
Molecular FormulaC15H21BrN2O3
Molecular Weight357.25 g/mol
Exact Mass356.07
IUPAC Name(2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide
SMILESC[C@@H](Oc1ccc(Br)cc1)C(=O)NCCN1CCOCC1
InChIInChI=1S/C15H21BrN2O3/c1-12(21-14-4-2-13(16)3-5-14)15(19)17-6-7-18-8-10-20-11-9-18/h2-5,12H,6-11H2,1H3,(H,17,19)/t12-/m1/s1
InChIKeyVUTSWKPHVFFHQY-GFCCVEGCSA-N
XLogP1.66
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.25
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methylphenoxy)-N-(2-morpholin-4-ylethyl)propanamide
CID 51163883
2-(4-chlorophenoxy)-N-(2-morpholin-4-ylethyl)propanamide
CID 51159478
2-(3-methylphenoxy)-N-(2-morpholin-4-ylethyl)propanamide
CID 21368370
2-(4-tert-butylphenoxy)-N-(3-morpholin-4-ylpropyl)propanamide
CID 51176280
N-(3-morpholin-4-ylpropyl)-2-(4-phenylphenoxy)propanamide
CID 55628607
2-(4-bromophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide
CID 132666019
2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide
CID 888119
(2R)-2-(2-methylphenoxy)-N-(2-morpholin-4-ylethyl)propanamide
CID 93488370
N-(2-morpholin-4-ylethyl)-4-propan-2-yloxybenzamide
CID 6471257
(2S)-2-[4-[methyl(methylsulfonyl)amino]phenoxy]-N-(3-morpholin-4-ylpropyl)propanamide
CID 100521021
N-[2-(azepan-1-yl)ethyl]-2-phenoxypropanamide
CID 86929905
(2R)-2-(4-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide
CID 93486880

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide?
The IUPAC name of (2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide (CID 2203701) is (2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide.
What is the SMILES notation for (2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide?
The canonical SMILES for (2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide is C[C@@H](Oc1ccc(Br)cc1)C(=O)NCCN1CCOCC1.
What is the InChIKey of (2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide?
The InChIKey is VUTSWKPHVFFHQY-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H21BrN2O3/c1-12(21-14-4-2-13(16)3-5-14)15(19)17-6-7-18-8-10-20-11-9-18/h2-5,12H,6-11H2,1H3,(H,17,19)/t12-/m1/s1.
What are the key properties of (2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide?
(2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide has a molecular weight of 357.25 g/mol, XLogP of 1.66, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide is sourced from PubChem (CID 2203701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).