2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine

C7H4F5IN2 — CID 130105387

IUPAC2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine
SMILESNc1c(I)cc(C(F)(F)F)nc1C(F)F
InChIInChI=1S/C7H4F5IN2/c8-6(9)5-4(14)2(13)1-3(15-5)7(10,11)12/h1,6H,14H2
InChIKeyPZLVJGVOSMBMKJ-UHFFFAOYSA-N
MW338.02 g/mol
LogP3.22
Rot. Bonds1

About 2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine

2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine (PubChem CID 130105387) has the molecular formula C7H4F5IN2 and a molecular weight of 338.02 g/mol. Its IUPAC name is 2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine.

Molecular Properties

Compound Name2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine
PubChem CID130105387
Molecular FormulaC7H4F5IN2
Molecular Weight338.02 g/mol
Exact Mass337.93
IUPAC Name2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine
SMILESNc1c(I)cc(C(F)(F)F)nc1C(F)F
InChIInChI=1S/C7H4F5IN2/c8-6(9)5-4(14)2(13)1-3(15-5)7(10,11)12/h1,6H,14H2
InChIKeyPZLVJGVOSMBMKJ-UHFFFAOYSA-N
XLogP3.22
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.02
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-ol
CID 118831592
2-(difluoromethyl)-4-iodo-3-methoxy-6-(trifluoromethyl)pyridine
CID 118809295
2-(difluoromethyl)-4-methoxy-6-(trifluoromethyl)pyridin-3-amine
CID 130106010
[2-(difluoromethyl)-3-iodo-6-(trifluoromethyl)-4-pyridinyl]methanamine
CID 130086828
3-(difluoromethyl)-4-iodo-2-methoxy-6-(trifluoromethyl)pyridine
CID 130085659
2-(difluoromethyl)-3-iodo-4-(trifluoromethoxy)-6-(trifluoromethyl)pyridine
CID 134681322
4-amino-2-(difluoromethyl)-6-(trifluoromethyl)pyridine-3-carboxylic acid
CID 118822759
6-(difluoromethyl)-4-(trifluoromethyl)pyridine-2,5-diamine
CID 134672254
6-(difluoromethyl)-2,5-diiodopyridin-3-amine
CID 130100401
2-cyclopropyl-3-fluoro-4-iodo-6-(trifluoromethyl)pyridine;2-cyclopropyl-4-iodo-6-(trifluoromethyl)pyridin-3-amine
CID 158064623
2-iodo-6-(trifluoromethyl)pyridin-4-amine
CID 118801119
4-(bromomethyl)-2-(difluoromethyl)-3-methoxy-6-(trifluoromethyl)pyridine
CID 118801682

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine?
The IUPAC name of 2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine (CID 130105387) is 2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine.
What is the SMILES notation for 2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine?
The canonical SMILES for 2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine is Nc1c(I)cc(C(F)(F)F)nc1C(F)F.
What is the InChIKey of 2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine?
The InChIKey is PZLVJGVOSMBMKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F5IN2/c8-6(9)5-4(14)2(13)1-3(15-5)7(10,11)12/h1,6H,14H2.
What are the key properties of 2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine?
2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine has a molecular weight of 338.02 g/mol, XLogP of 3.22, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-4-iodo-6-(trifluoromethyl)pyridin-3-amine is sourced from PubChem (CID 130105387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).