2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine

C6H4F3IN2 — CID 130103853

IUPAC2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine
SMILESNc1c(C(F)F)ncc(I)c1F
InChIInChI=1S/C6H4F3IN2/c7-3-2(10)1-12-5(4(3)11)6(8)9/h1,6H,11H2
InChIKeySMMDBSFSGYFXTR-UHFFFAOYSA-N
MW288.01 g/mol
LogP2.35
Rot. Bonds1

About 2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine

2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine (PubChem CID 130103853) has the molecular formula C6H4F3IN2 and a molecular weight of 288.01 g/mol. Its IUPAC name is 2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine.

Molecular Properties

Compound Name2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine
PubChem CID130103853
Molecular FormulaC6H4F3IN2
Molecular Weight288.01 g/mol
Exact Mass287.94
IUPAC Name2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine
SMILESNc1c(C(F)F)ncc(I)c1F
InChIInChI=1S/C6H4F3IN2/c7-3-2(10)1-12-5(4(3)11)6(8)9/h1,6H,11H2
InChIKeySMMDBSFSGYFXTR-UHFFFAOYSA-N
XLogP2.35
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.01
LogP ≤ 52.35
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-fluoro-5-iodopyridin-3-ol
CID 118820579
4-(bromomethyl)-2-(difluoromethyl)-5-iodopyridin-3-amine
CID 130105305
5-amino-6-(difluoromethyl)-4-fluoropyridine-3-carbaldehyde
CID 130104215
[2-(difluoromethyl)-3-fluoro-5-iodo-4-pyridinyl]methanamine
CID 118801498
2-(difluoromethyl)-4-fluoro-5-methoxypyridin-3-amine
CID 130103884
2-(difluoromethyl)-3,5-difluoropyridin-4-amine
CID 118812171
2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine
CID 130105197
2-(difluoromethyl)-5-iodopyridin-3-amine
CID 130094620
4-amino-6-(difluoromethyl)-5-fluoropyridine-3-carbaldehyde
CID 118851291
4-amino-6-(difluoromethyl)-5-fluoropyridin-3-ol
CID 118806774
2-(difluoromethyl)-3-fluoro-5-iodopyridine-4-carboxylic acid
CID 118837172
4-amino-6-(difluoromethyl)-5-iodopyridin-3-ol
CID 118823512

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine?
The IUPAC name of 2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine (CID 130103853) is 2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine.
What is the SMILES notation for 2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine?
The canonical SMILES for 2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine is Nc1c(C(F)F)ncc(I)c1F.
What is the InChIKey of 2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine?
The InChIKey is SMMDBSFSGYFXTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F3IN2/c7-3-2(10)1-12-5(4(3)11)6(8)9/h1,6H,11H2.
What are the key properties of 2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine?
2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine has a molecular weight of 288.01 g/mol, XLogP of 2.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-4-fluoro-5-iodopyridin-3-amine is sourced from PubChem (CID 130103853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).