(2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol

C10H7FINOS — CID 58221419

IUPAC(2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol
SMILESOC(c1ccns1)c1cc(I)ccc1F
InChIInChI=1S/C10H7FINOS/c11-8-2-1-6(12)5-7(8)10(14)9-3-4-13-15-9/h1-5,10,14H
InChIKeyVCSGTFWBQXJVTE-UHFFFAOYSA-N
MW335.14 g/mol
LogP2.97
Rot. Bonds2

About (2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol

(2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol (PubChem CID 58221419) has the molecular formula C10H7FINOS and a molecular weight of 335.14 g/mol. Its IUPAC name is (2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol.

Molecular Properties

Compound Name(2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol
PubChem CID58221419
Molecular FormulaC10H7FINOS
Molecular Weight335.14 g/mol
Exact Mass334.93
IUPAC Name(2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol
SMILESOC(c1ccns1)c1cc(I)ccc1F
InChIInChI=1S/C10H7FINOS/c11-8-2-1-6(12)5-7(8)10(14)9-3-4-13-15-9/h1-5,10,14H
InChIKeyVCSGTFWBQXJVTE-UHFFFAOYSA-N
XLogP2.97
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.14
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

(4-Fluorophenyl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 119094110
(2,4-Difluorophenyl)-phenyl-(1,2-thiazol-5-yl)methanol
CID 20253738
(2-Fluoro-5-methylphenyl)-(1,2-thiazol-5-yl)methanol
CID 143918348
alpha,alpha-Diphenyl-5-isothiazolemethanol
CID 3731134
(3-Methyl-1,2-thiazol-5-yl)-phenylmethanol
CID 91620842
(4-Chlorophenyl)-(1,2-thiazol-5-yl)methanol
CID 119087694
(4-Methylphenyl)-(1,2-thiazol-5-yl)methanol
CID 119094111
(3-Chlorophenyl)-(1,2-thiazol-5-yl)methanol
CID 130794593
(4-Propan-2-ylphenyl)-(1,2-thiazol-5-yl)methanol
CID 134975462
(4-Fluorophenyl)(1,2-thiazol-5-yl)methanol
CID 45158862
(S)-(4-fluorophenyl)-(1,2-thiazol-5-yl)methanol
CID 51900820
(R)-(4-fluorophenyl)-(1,2-thiazol-5-yl)methanol
CID 51900821

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol?
The IUPAC name of (2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol (CID 58221419) is (2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol.
What is the SMILES notation for (2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol?
The canonical SMILES for (2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol is OC(c1ccns1)c1cc(I)ccc1F.
What is the InChIKey of (2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol?
The InChIKey is VCSGTFWBQXJVTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FINOS/c11-8-2-1-6(12)5-7(8)10(14)9-3-4-13-15-9/h1-5,10,14H.
What are the key properties of (2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol?
(2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol has a molecular weight of 335.14 g/mol, XLogP of 2.97, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol is sourced from PubChem (CID 58221419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).