(5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone

C15H14BrNO3 — CID 31414929

IUPAC(5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone
SMILESO=C(c1ccc(Br)o1)N1CCO[C@H](c2ccccc2)C1
InChIInChI=1S/C15H14BrNO3/c16-14-7-6-12(20-14)15(18)17-8-9-19-13(10-17)11-4-2-1-3-5-11/h1-7,13H,8-10H2/t13-/m0/s1
InChIKeyDBVBPJDLOXXUGT-ZDUSSCGKSA-N
MW336.19 g/mol
LogP3.26
Rot. Bonds2

About (5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone

(5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone (PubChem CID 31414929) has the molecular formula C15H14BrNO3 and a molecular weight of 336.19 g/mol. Its IUPAC name is (5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone.

Molecular Properties

Compound Name(5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone
PubChem CID31414929
Molecular FormulaC15H14BrNO3
Molecular Weight336.19 g/mol
Exact Mass335.02
IUPAC Name(5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone
SMILESO=C(c1ccc(Br)o1)N1CCO[C@H](c2ccccc2)C1
InChIInChI=1S/C15H14BrNO3/c16-14-7-6-12(20-14)15(18)17-8-9-19-13(10-17)11-4-2-1-3-5-11/h1-7,13H,8-10H2/t13-/m0/s1
InChIKeyDBVBPJDLOXXUGT-ZDUSSCGKSA-N
XLogP3.26
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.19
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-bromo-2-pyridinyl)-(2-phenylmorpholin-4-yl)methanone
CID 107518605
(3-bromo-5-fluorophenyl)-(2-phenylmorpholin-4-yl)methanone
CID 110629876
morpholin-4-yl-(2-phenylmorpholin-4-yl)methanone
CID 110291317
(2-phenylmorpholin-4-yl)-(4-propan-2-ylphenyl)methanone
CID 84510718
[2-(3-bromophenyl)morpholin-4-yl]-(furan-2-yl)methanone
CID 110364402
(2-bromo-5-propan-2-yl-1,3-thiazol-4-yl)-[(2S)-2-phenylmorpholin-4-yl]methanone
CID 97264285
2-amino-2-phenyl-1-(2-phenylmorpholin-4-yl)ethanone;hydrochloride
CID 119278824
(5-bromofuran-2-yl)-[(7R)-1,1-dioxo-7-phenyl-1,4-thiazepan-4-yl]methanone
CID 129357238
[(2R)-2-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone
CID 31414918
1-phenyl-3-[4-(2-phenylmorpholine-4-carbonyl)phenyl]urea
CID 71898747
(2,4-dichlorophenyl)-[(2R)-2-phenylmorpholin-4-yl]methanone
CID 25281298
(4-bromo-5-cyclopropyl-1H-pyrazol-3-yl)-[(2S)-2-phenylmorpholin-4-yl]methanone
CID 52534001

Frequently Asked Questions

What is the IUPAC name of (5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone?
The IUPAC name of (5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone (CID 31414929) is (5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone.
What is the SMILES notation for (5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone?
The canonical SMILES for (5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone is O=C(c1ccc(Br)o1)N1CCO[C@H](c2ccccc2)C1.
What is the InChIKey of (5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone?
The InChIKey is DBVBPJDLOXXUGT-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H14BrNO3/c16-14-7-6-12(20-14)15(18)17-8-9-19-13(10-17)11-4-2-1-3-5-11/h1-7,13H,8-10H2/t13-/m0/s1.
What are the key properties of (5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone?
(5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone has a molecular weight of 336.19 g/mol, XLogP of 3.26, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromofuran-2-yl)-[(2R)-2-phenylmorpholin-4-yl]methanone is sourced from PubChem (CID 31414929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).