6-(difluoromethyl)-2,5-diiodopyridin-3-amine

C6H4F2I2N2 — CID 130100401

IUPAC6-(difluoromethyl)-2,5-diiodopyridin-3-amine
SMILESNc1cc(I)c(C(F)F)nc1I
InChIInChI=1S/C6H4F2I2N2/c7-5(8)4-2(9)1-3(11)6(10)12-4/h1,5H,11H2
InChIKeyONRKOKPVKHHPKZ-UHFFFAOYSA-N
MW395.92 g/mol
LogP2.81
Rot. Bonds1

About 6-(difluoromethyl)-2,5-diiodopyridin-3-amine

6-(difluoromethyl)-2,5-diiodopyridin-3-amine (PubChem CID 130100401) has the molecular formula C6H4F2I2N2 and a molecular weight of 395.92 g/mol. Its IUPAC name is 6-(difluoromethyl)-2,5-diiodopyridin-3-amine.

Molecular Properties

Compound Name6-(difluoromethyl)-2,5-diiodopyridin-3-amine
PubChem CID130100401
Molecular FormulaC6H4F2I2N2
Molecular Weight395.92 g/mol
Exact Mass395.84
IUPAC Name6-(difluoromethyl)-2,5-diiodopyridin-3-amine
SMILESNc1cc(I)c(C(F)F)nc1I
InChIInChI=1S/C6H4F2I2N2/c7-5(8)4-2(9)1-3(11)6(10)12-4/h1,5H,11H2
InChIKeyONRKOKPVKHHPKZ-UHFFFAOYSA-N
XLogP2.81
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.92
LogP ≤ 52.81
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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Related Compounds

[2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol
CID 118993177
3-(aminomethyl)-6-(difluoromethyl)-5-iodopyridin-2-amine
CID 119017545
2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine
CID 130100474
[2-(difluoromethyl)-5,6-diiodo-3-pyridinyl]methanamine
CID 130100564
methyl 2-[3-amino-6-(difluoromethyl)-5-iodo-2-pyridinyl]acetate
CID 134683210
2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine
CID 130105387
5-chloro-2-(difluoromethyl)-6-fluoro-3-iodopyridine
CID 130071572
[6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol
CID 118854432
2-(difluoromethyl)-5-iodopyridin-3-amine
CID 130094620
5-(difluoromethyl)-6-iodopyridine-2,3-diamine
CID 118990847
3-(bromomethyl)-2-chloro-6-(difluoromethyl)-5-iodopyridine
CID 130073132
2-[2-(difluoromethyl)-5,6-diiodo-3-pyridinyl]acetic acid
CID 130100706

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-2,5-diiodopyridin-3-amine?
The IUPAC name of 6-(difluoromethyl)-2,5-diiodopyridin-3-amine (CID 130100401) is 6-(difluoromethyl)-2,5-diiodopyridin-3-amine.
What is the SMILES notation for 6-(difluoromethyl)-2,5-diiodopyridin-3-amine?
The canonical SMILES for 6-(difluoromethyl)-2,5-diiodopyridin-3-amine is Nc1cc(I)c(C(F)F)nc1I.
What is the InChIKey of 6-(difluoromethyl)-2,5-diiodopyridin-3-amine?
The InChIKey is ONRKOKPVKHHPKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F2I2N2/c7-5(8)4-2(9)1-3(11)6(10)12-4/h1,5H,11H2.
What are the key properties of 6-(difluoromethyl)-2,5-diiodopyridin-3-amine?
6-(difluoromethyl)-2,5-diiodopyridin-3-amine has a molecular weight of 395.92 g/mol, XLogP of 2.81, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-2,5-diiodopyridin-3-amine is sourced from PubChem (CID 130100401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).