2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine

C6H3F3I2N2O — CID 131214175

IUPAC2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine
SMILESNc1c(I)cc(OC(F)(F)F)nc1I
InChIInChI=1S/C6H3F3I2N2O/c7-6(8,9)14-3-1-2(10)4(12)5(11)13-3/h1H,12H2
InChIKeyUZHHLHPWDMVZLV-UHFFFAOYSA-N
MW429.91 g/mol
LogP2.77
Rot. Bonds1

About 2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine

2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine (PubChem CID 131214175) has the molecular formula C6H3F3I2N2O and a molecular weight of 429.91 g/mol. Its IUPAC name is 2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine.

Molecular Properties

Compound Name2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine
PubChem CID131214175
Molecular FormulaC6H3F3I2N2O
Molecular Weight429.91 g/mol
Exact Mass429.83
IUPAC Name2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine
SMILESNc1c(I)cc(OC(F)(F)F)nc1I
InChIInChI=1S/C6H3F3I2N2O/c7-6(8,9)14-3-1-2(10)4(12)5(11)13-3/h1H,12H2
InChIKeyUZHHLHPWDMVZLV-UHFFFAOYSA-N
XLogP2.77
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.91
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

3-(aminomethyl)-2-iodo-6-(trifluoromethoxy)pyridin-4-amine
CID 131601200
3-(difluoromethyl)-2-iodo-6-(trifluoromethoxy)pyridin-4-amine
CID 118823436
2,4-dibromo-6-(trifluoromethoxy)pyridin-3-amine
CID 130093565
4-iodo-3-methyl-6-(trifluoromethoxy)-2-(trifluoromethyl)pyridine
CID 134681197
4-(difluoromethyl)-3-fluoro-2-iodo-6-(trifluoromethoxy)pyridine
CID 118851432
[2-iodo-3-methoxy-6-(trifluoromethoxy)-4-pyridinyl]methanamine
CID 118807180
4-iodo-3-methoxy-6-(trifluoromethoxy)-2-(trifluoromethyl)pyridine
CID 134666974
4-(difluoromethyl)-2-iodo-6-(trifluoromethoxy)pyridin-3-ol
CID 118823942
3-(bromomethyl)-2-iodo-4-methyl-6-(trifluoromethoxy)pyridine
CID 130112748
2-(chloromethyl)-4-iodo-6-(trifluoromethoxy)-3-(trifluoromethyl)pyridine
CID 134676595
3-(chloromethyl)-2-iodo-4-methyl-6-(trifluoromethoxy)pyridine
CID 130112791
4-(aminomethyl)-3-iodo-6-(trifluoromethoxy)pyridin-2-amine
CID 119006806

Frequently Asked Questions

What is the IUPAC name of 2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine?
The IUPAC name of 2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine (CID 131214175) is 2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine.
What is the SMILES notation for 2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine?
The canonical SMILES for 2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine is Nc1c(I)cc(OC(F)(F)F)nc1I.
What is the InChIKey of 2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine?
The InChIKey is UZHHLHPWDMVZLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3F3I2N2O/c7-6(8,9)14-3-1-2(10)4(12)5(11)13-3/h1H,12H2.
What are the key properties of 2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine?
2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine has a molecular weight of 429.91 g/mol, XLogP of 2.77, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diiodo-6-(trifluoromethoxy)pyridin-3-amine is sourced from PubChem (CID 131214175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).