(Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol

C11H9FN2O2 — CID 22631223

IUPAC(Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol
SMILESOC/C=C(\F)c1ccc(-c2ncon2)cc1
InChIInChI=1S/C11H9FN2O2/c12-10(5-6-15)8-1-3-9(4-2-8)11-13-7-16-14-11/h1-5,7,15H,6H2/b10-5-
InChIKeyGETARFVWQWJYJH-YHYXMXQVSA-N
MW220.20 g/mol
LogP2.04
Rot. Bonds3

About (Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol

(Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol (PubChem CID 22631223) has the molecular formula C11H9FN2O2 and a molecular weight of 220.20 g/mol. Its IUPAC name is (Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol.

Molecular Properties

Compound Name(Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol
PubChem CID22631223
Molecular FormulaC11H9FN2O2
Molecular Weight220.20 g/mol
Exact Mass220.06
IUPAC Name(Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol
SMILESOC/C=C(\F)c1ccc(-c2ncon2)cc1
InChIInChI=1S/C11H9FN2O2/c12-10(5-6-15)8-1-3-9(4-2-8)11-13-7-16-14-11/h1-5,7,15H,6H2/b10-5-
InChIKeyGETARFVWQWJYJH-YHYXMXQVSA-N
XLogP2.04
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.20
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1,2,4-oxadiazol-3-yl)phenol
CID 135760588
3-[4-[(Z)-2-fluoroprop-1-enyl]phenyl]-1,2,4-oxadiazole
CID 174462824
3-[4-(chloromethyl)phenyl]-1,2,4-oxadiazole
CID 134817589
4-(1,2,4-oxadiazol-3-yl)benzene-1,2-diamine
CID 67440607
3-[4-(2-fluoropropan-2-yl)phenyl]-1,2,4-oxadiazole
CID 91422984
[3-(1,2,4-oxadiazol-3-yl)phenyl]methanol
CID 134817586
4-(1,2,4-oxadiazol-3-yl)benzenesulfonyl chloride
CID 84704593
N-(2-amino-2-methylpropyl)-4-(1,2,4-oxadiazol-3-yl)benzamide
CID 119629350
N-(3-aminopropyl)-4-(1,2,4-oxadiazol-3-yl)benzamide
CID 119407873
4-methyl-4-[[4-(1,2,4-oxadiazol-3-yl)benzoyl]amino]pentanoic acid
CID 119357421
fluorocyclopropane;methanamine;3-(4-methylphenyl)-1,2,4-oxadiazole
CID 178051213
N-[2-(ethylamino)ethyl]-4-(1,2,4-oxadiazol-3-yl)benzamide
CID 119508201

Frequently Asked Questions

What is the IUPAC name of (Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol?
The IUPAC name of (Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol (CID 22631223) is (Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol.
What is the SMILES notation for (Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol?
The canonical SMILES for (Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol is OC/C=C(\F)c1ccc(-c2ncon2)cc1.
What is the InChIKey of (Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol?
The InChIKey is GETARFVWQWJYJH-YHYXMXQVSA-N. The full InChI is InChI=1S/C11H9FN2O2/c12-10(5-6-15)8-1-3-9(4-2-8)11-13-7-16-14-11/h1-5,7,15H,6H2/b10-5-.
What are the key properties of (Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol?
(Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol has a molecular weight of 220.20 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-fluoro-3-[4-(1,2,4-oxadiazol-3-yl)phenyl]prop-2-en-1-ol is sourced from PubChem (CID 22631223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).