(Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol

C12H10FNOS — CID 22630898

IUPAC(Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol
SMILESOC/C=C(\F)c1ccc(-c2ccccn2)s1
InChIInChI=1S/C12H10FNOS/c13-9(6-8-15)11-4-5-12(16-11)10-3-1-2-7-14-10/h1-7,15H,8H2/b9-6-
InChIKeyICFBSFUTWLBLEE-TWGQIWQCSA-N
MW235.28 g/mol
LogP3.11
Rot. Bonds3

About (Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol

(Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol (PubChem CID 22630898) has the molecular formula C12H10FNOS and a molecular weight of 235.28 g/mol. Its IUPAC name is (Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol.

Molecular Properties

Compound Name(Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol
PubChem CID22630898
Molecular FormulaC12H10FNOS
Molecular Weight235.28 g/mol
Exact Mass235.05
IUPAC Name(Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol
SMILESOC/C=C(\F)c1ccc(-c2ccccn2)s1
InChIInChI=1S/C12H10FNOS/c13-9(6-8-15)11-4-5-12(16-11)10-3-1-2-7-14-10/h1-7,15H,8H2/b9-6-
InChIKeyICFBSFUTWLBLEE-TWGQIWQCSA-N
XLogP3.11
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol?
The IUPAC name of (Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol (CID 22630898) is (Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol.
What is the SMILES notation for (Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol?
The canonical SMILES for (Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol is OC/C=C(\F)c1ccc(-c2ccccn2)s1.
What is the InChIKey of (Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol?
The InChIKey is ICFBSFUTWLBLEE-TWGQIWQCSA-N. The full InChI is InChI=1S/C12H10FNOS/c13-9(6-8-15)11-4-5-12(16-11)10-3-1-2-7-14-10/h1-7,15H,8H2/b9-6-.
What are the key properties of (Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol?
(Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol has a molecular weight of 235.28 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-fluoro-3-(5-pyridin-2-ylthiophen-2-yl)prop-2-en-1-ol is sourced from PubChem (CID 22630898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).