(5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone

C15H14FN3O5 — CID 136564948

IUPAC(5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone
SMILESCc1nnc(C2CN(C(=O)c3c(F)ccc4c3OCO4)CCO2)o1
InChIInChI=1S/C15H14FN3O5/c1-8-17-18-14(24-8)11-6-19(4-5-21-11)15(20)12-9(16)2-3-10-13(12)23-7-22-10/h2-3,11H,4-7H2,1H3
InChIKeyQQWDHXLUVYIHCK-UHFFFAOYSA-N
MW335.29 g/mol
LogP1.46
Rot. Bonds2

About (5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone

(5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone (PubChem CID 136564948) has the molecular formula C15H14FN3O5 and a molecular weight of 335.29 g/mol. Its IUPAC name is (5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone
PubChem CID136564948
Molecular FormulaC15H14FN3O5
Molecular Weight335.29 g/mol
Exact Mass335.09
IUPAC Name(5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone
SMILESCc1nnc(C2CN(C(=O)c3c(F)ccc4c3OCO4)CCO2)o1
InChIInChI=1S/C15H14FN3O5/c1-8-17-18-14(24-8)11-6-19(4-5-21-11)15(20)12-9(16)2-3-10-13(12)23-7-22-10/h2-3,11H,4-7H2,1H3
InChIKeyQQWDHXLUVYIHCK-UHFFFAOYSA-N
XLogP1.46
TPSA86.92 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.29
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze (5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone 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

[(2R)-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]-(2,4,5-trimethylfuran-3-yl)methanone
CID 129326893
1-[(2R)-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]-2-(2,4,5-trifluorophenyl)ethanone
CID 129327013
(3-methyl-1-benzofuran-2-yl)-[(2S)-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone
CID 129325788
(4,5-dimethylthiophen-2-yl)-[(2S)-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone
CID 129326186
(3,7-dimethyl-1-benzofuran-2-yl)-[(2S)-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone
CID 129327895
4-[(2R)-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine-4-carbonyl]-1H-quinolin-2-one
CID 129326425
(2,3-dimethyl-1H-indol-5-yl)-[(2S)-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone
CID 129326330
4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine-4-carbonyl]-1H-quinolin-2-one
CID 129001862
(2R)-2-cyclopropyl-1-[(2S)-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]-2-phenylethanone
CID 129327530
(2S)-2-(5-chlorothiophen-2-yl)-1-[(2S)-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one
CID 129327130
(2S)-2-(dimethylamino)-1-[(2S)-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]-3-phenylpropan-1-one
CID 129326546
(2S)-2-(2,3-dihydroindol-1-yl)-1-[(2S)-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one
CID 129326095

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone?
The IUPAC name of (5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone (CID 136564948) is (5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone.
What is the SMILES notation for (5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone?
The canonical SMILES for (5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone is Cc1nnc(C2CN(C(=O)c3c(F)ccc4c3OCO4)CCO2)o1.
What is the InChIKey of (5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone?
The InChIKey is QQWDHXLUVYIHCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O5/c1-8-17-18-14(24-8)11-6-19(4-5-21-11)15(20)12-9(16)2-3-10-13(12)23-7-22-10/h2-3,11H,4-7H2,1H3.
What are the key properties of (5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone?
(5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone has a molecular weight of 335.29 g/mol, XLogP of 1.46, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-1,3-benzodioxol-4-yl)-[2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone is sourced from PubChem (CID 136564948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).