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

C6H4F4N2 — CID 130099529

IUPAC6-(difluoromethyl)-2,5-difluoropyridin-3-amine
SMILESNc1cc(F)c(C(F)F)nc1F
InChIInChI=1S/C6H4F4N2/c7-2-1-3(11)6(10)12-4(2)5(8)9/h1,5H,11H2
InChIKeyPLQJXLZPFVNKTQ-UHFFFAOYSA-N
MW180.10 g/mol
LogP1.88
Rot. Bonds1

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

6-(difluoromethyl)-2,5-difluoropyridin-3-amine (PubChem CID 130099529) has the molecular formula C6H4F4N2 and a molecular weight of 180.10 g/mol. Its IUPAC name is 6-(difluoromethyl)-2,5-difluoropyridin-3-amine.

Molecular Properties

Compound Name6-(difluoromethyl)-2,5-difluoropyridin-3-amine
PubChem CID130099529
Molecular FormulaC6H4F4N2
Molecular Weight180.10 g/mol
Exact Mass180.03
IUPAC Name6-(difluoromethyl)-2,5-difluoropyridin-3-amine
SMILESNc1cc(F)c(C(F)F)nc1F
InChIInChI=1S/C6H4F4N2/c7-2-1-3(11)6(10)12-4(2)5(8)9/h1,5H,11H2
InChIKeyPLQJXLZPFVNKTQ-UHFFFAOYSA-N
XLogP1.88
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.10
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(difluoromethyl)-6-fluoropyridine-3,5-diamine
CID 130098608
6-(difluoromethyl)-5-fluoropyridine-2,3-diamine
CID 130098596
5-chloro-6-(difluoromethyl)-2-fluoropyridin-3-amine
CID 130102453
5-amino-2-(difluoromethyl)-6-fluoropyridine-3-carbonitrile
CID 130103195
2-(difluoromethyl)-3,6-difluoro-5-methylpyridine
CID 130099696
5-amino-6-(difluoromethyl)-2-fluoropyridine-3-carbonitrile
CID 130103192
2-[6-(difluoromethyl)-2,5-difluoro-3-pyridinyl]acetonitrile
CID 130099811
6-chloro-5-(difluoromethyl)-2-fluoropyridin-3-amine
CID 130102456
ethyl 2-[3-amino-6-(difluoromethyl)-5-fluoro-2-pyridinyl]acetate
CID 134683603
2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine
CID 130100474
6-(difluoromethyl)-5-fluoropyridine-2,4-diamine
CID 118805803
ethyl 2-[6-(difluoromethyl)-2,5-difluoro-3-pyridinyl]acetate
CID 134661756

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-2,5-difluoropyridin-3-amine?
The IUPAC name of 6-(difluoromethyl)-2,5-difluoropyridin-3-amine (CID 130099529) is 6-(difluoromethyl)-2,5-difluoropyridin-3-amine.
What is the SMILES notation for 6-(difluoromethyl)-2,5-difluoropyridin-3-amine?
The canonical SMILES for 6-(difluoromethyl)-2,5-difluoropyridin-3-amine is Nc1cc(F)c(C(F)F)nc1F.
What is the InChIKey of 6-(difluoromethyl)-2,5-difluoropyridin-3-amine?
The InChIKey is PLQJXLZPFVNKTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F4N2/c7-2-1-3(11)6(10)12-4(2)5(8)9/h1,5H,11H2.
What are the key properties of 6-(difluoromethyl)-2,5-difluoropyridin-3-amine?
6-(difluoromethyl)-2,5-difluoropyridin-3-amine has a molecular weight of 180.10 g/mol, XLogP of 1.88, 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-difluoropyridin-3-amine is sourced from PubChem (CID 130099529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).