2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine

C7H7F2IN2 — CID 130105197

IUPAC2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine
SMILESCc1cnc(C(F)F)c(N)c1I
InChIInChI=1S/C7H7F2IN2/c1-3-2-12-6(7(8)9)5(11)4(3)10/h2,7H,11H2,1H3
InChIKeyGFZADOIGHCYQHI-UHFFFAOYSA-N
MW284.05 g/mol
LogP2.51
Rot. Bonds1

About 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine

2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine (PubChem CID 130105197) has the molecular formula C7H7F2IN2 and a molecular weight of 284.05 g/mol. Its IUPAC name is 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine.

Molecular Properties

Compound Name2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine
PubChem CID130105197
Molecular FormulaC7H7F2IN2
Molecular Weight284.05 g/mol
Exact Mass283.96
IUPAC Name2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine
SMILESCc1cnc(C(F)F)c(N)c1I
InChIInChI=1S/C7H7F2IN2/c1-3-2-12-6(7(8)9)5(11)4(3)10/h2,7H,11H2,1H3
InChIKeyGFZADOIGHCYQHI-UHFFFAOYSA-N
XLogP2.51
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.05
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine?
The IUPAC name of 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine (CID 130105197) is 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine.
What is the SMILES notation for 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine?
The canonical SMILES for 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine is Cc1cnc(C(F)F)c(N)c1I.
What is the InChIKey of 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine?
The InChIKey is GFZADOIGHCYQHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F2IN2/c1-3-2-12-6(7(8)9)5(11)4(3)10/h2,7H,11H2,1H3.
What are the key properties of 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine?
2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine has a molecular weight of 284.05 g/mol, XLogP of 2.51, 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-5-methylpyridin-3-amine is sourced from PubChem (CID 130105197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).