4-(difluoromethyl)-2-iodopyridin-3-ol

C6H4F2INO — CID 118801182

IUPAC4-(difluoromethyl)-2-iodopyridin-3-ol
SMILESOc1c(C(F)F)ccnc1I
InChIInChI=1S/C6H4F2INO/c7-5(8)3-1-2-10-6(9)4(3)11/h1-2,5,11H
InChIKeyYJNHMNZVSDSZRK-UHFFFAOYSA-N
MW271.00 g/mol
LogP2.33
Rot. Bonds1

About 4-(difluoromethyl)-2-iodopyridin-3-ol

4-(difluoromethyl)-2-iodopyridin-3-ol (PubChem CID 118801182) has the molecular formula C6H4F2INO and a molecular weight of 271.00 g/mol. Its IUPAC name is 4-(difluoromethyl)-2-iodopyridin-3-ol.

Molecular Properties

Compound Name4-(difluoromethyl)-2-iodopyridin-3-ol
PubChem CID118801182
Molecular FormulaC6H4F2INO
Molecular Weight271.00 g/mol
Exact Mass270.93
IUPAC Name4-(difluoromethyl)-2-iodopyridin-3-ol
SMILESOc1c(C(F)F)ccnc1I
InChIInChI=1S/C6H4F2INO/c7-5(8)3-1-2-10-6(9)4(3)11/h1-2,5,11H
InChIKeyYJNHMNZVSDSZRK-UHFFFAOYSA-N
XLogP2.33
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.00
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-2-iodopyridin-3-ol?
The IUPAC name of 4-(difluoromethyl)-2-iodopyridin-3-ol (CID 118801182) is 4-(difluoromethyl)-2-iodopyridin-3-ol.
What is the SMILES notation for 4-(difluoromethyl)-2-iodopyridin-3-ol?
The canonical SMILES for 4-(difluoromethyl)-2-iodopyridin-3-ol is Oc1c(C(F)F)ccnc1I.
What is the InChIKey of 4-(difluoromethyl)-2-iodopyridin-3-ol?
The InChIKey is YJNHMNZVSDSZRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F2INO/c7-5(8)3-1-2-10-6(9)4(3)11/h1-2,5,11H.
What are the key properties of 4-(difluoromethyl)-2-iodopyridin-3-ol?
4-(difluoromethyl)-2-iodopyridin-3-ol has a molecular weight of 271.00 g/mol, XLogP of 2.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-2-iodopyridin-3-ol is sourced from PubChem (CID 118801182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).