(4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone

C10H7FN2O2 — CID 139878976

IUPAC(4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone
SMILESCc1nonc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C10H7FN2O2/c1-6-9(13-15-12-6)10(14)7-2-4-8(11)5-3-7/h2-5H,1H3
InChIKeySCCLXEZKUKGZSM-UHFFFAOYSA-N
MW206.18 g/mol
LogP1.75
Rot. Bonds2

About (4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone

(4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone (PubChem CID 139878976) has the molecular formula C10H7FN2O2 and a molecular weight of 206.18 g/mol. Its IUPAC name is (4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone
PubChem CID139878976
Molecular FormulaC10H7FN2O2
Molecular Weight206.18 g/mol
Exact Mass206.05
IUPAC Name(4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone
SMILESCc1nonc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C10H7FN2O2/c1-6-9(13-15-12-6)10(14)7-2-4-8(11)5-3-7/h2-5H,1H3
InChIKeySCCLXEZKUKGZSM-UHFFFAOYSA-N
XLogP1.75
TPSA55.99 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.18
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-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

(4-methyl-1,2,5-oxadiazol-3-yl)-phenylmethanone
CID 13415356
[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone
CID 71691416
(3,6-dimethylpyridazin-4-yl)-(4-fluorophenyl)methanone
CID 105078698
(3,5-dimethylphenyl)-(4-fluorophenyl)methanone
CID 43159976
(4-fluorophenyl)-(1,2-thiazol-3-yl)methanone
CID 130709729
(4-fluorophenyl)-(3-methylfuran-2-yl)methanone
CID 43462648
(4-fluorophenyl)-phenylmethanone
CID 161464622
2-[(4-fluorophenyl)methyl]-3-(4-methyl-1,2,5-oxadiazol-3-yl)propanoic acid
CID 79418861
(4-fluorophenyl)-(4-methyl-[1,2,4]triazolo[5,1-c][1,2,4]triazin-3-yl)methanone
CID 66499299
[(E)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 4-fluorobenzoate
CID 6264956
bis(4-chlorophenyl)methanone;bis(4-fluorophenyl)methanone
CID 159883474
(3R)-4-[(4-fluorophenyl)methyl]-1-(4-methyl-1,2,5-oxadiazole-3-carbonyl)-3-propan-2-yl-1,4-diazepan-5-one
CID 95553878

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone?
The IUPAC name of (4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone (CID 139878976) is (4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone.
What is the SMILES notation for (4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone?
The canonical SMILES for (4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone is Cc1nonc1C(=O)c1ccc(F)cc1.
What is the InChIKey of (4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone?
The InChIKey is SCCLXEZKUKGZSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN2O2/c1-6-9(13-15-12-6)10(14)7-2-4-8(11)5-3-7/h2-5H,1H3.
What are the key properties of (4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone?
(4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone has a molecular weight of 206.18 g/mol, XLogP of 1.75, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone is sourced from PubChem (CID 139878976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).