5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine

C6H4ClF2IN2 — CID 119006864

IUPAC5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine
SMILESNc1nc(I)c(Cl)cc1C(F)F
InChIInChI=1S/C6H4ClF2IN2/c7-3-1-2(4(8)9)6(11)12-5(3)10/h1,4H,(H2,11,12)
InChIKeyJRHYDBFROBLLBI-UHFFFAOYSA-N
MW304.47 g/mol
LogP2.86
Rot. Bonds1

About 5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine

5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine (PubChem CID 119006864) has the molecular formula C6H4ClF2IN2 and a molecular weight of 304.47 g/mol. Its IUPAC name is 5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine.

Molecular Properties

Compound Name5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine
PubChem CID119006864
Molecular FormulaC6H4ClF2IN2
Molecular Weight304.47 g/mol
Exact Mass303.91
IUPAC Name5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine
SMILESNc1nc(I)c(Cl)cc1C(F)F
InChIInChI=1S/C6H4ClF2IN2/c7-3-1-2(4(8)9)6(11)12-5(3)10/h1,4H,(H2,11,12)
InChIKeyJRHYDBFROBLLBI-UHFFFAOYSA-N
XLogP2.86
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.47
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

4-chloro-5-(difluoromethyl)-2-iodopyridine
CID 118845024
5-(difluoromethyl)-6-iodopyridine-2,3-diamine
CID 118990847
3-(difluoromethyl)-6-iodo-5-(trifluoromethoxy)pyridin-2-amine
CID 119022211
3-(difluoromethyl)-6-iodo-5-nitropyridin-2-amine
CID 118997575
2-[6-amino-5-(difluoromethyl)-2-iodo-3-pyridinyl]acetonitrile
CID 119021329
6-(chloromethyl)-3-(difluoromethyl)-5-iodopyridin-2-amine
CID 119019561
5-chloro-4-(difluoromethyl)-2-iodopyridine
CID 130095401
5-(difluoromethyl)-6-iodo-3-(trifluoromethyl)pyridin-2-amine
CID 118999966
2-amino-5-(difluoromethyl)-6-iodopyridine-3-carboxylic acid
CID 119020796
6-chloro-3-(difluoromethyl)-5-methoxypyridin-2-amine
CID 130102532
methyl 2-[6-amino-3-chloro-5-(difluoromethyl)-2-pyridinyl]acetate
CID 134661772
6-amino-5-(difluoromethyl)-3-iodopyridine-2-carboxylic acid
CID 119023037

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine?
The IUPAC name of 5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine (CID 119006864) is 5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine.
What is the SMILES notation for 5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine?
The canonical SMILES for 5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine is Nc1nc(I)c(Cl)cc1C(F)F.
What is the InChIKey of 5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine?
The InChIKey is JRHYDBFROBLLBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4ClF2IN2/c7-3-1-2(4(8)9)6(11)12-5(3)10/h1,4H,(H2,11,12).
What are the key properties of 5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine?
5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine has a molecular weight of 304.47 g/mol, XLogP of 2.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(difluoromethyl)-6-iodopyridin-2-amine is sourced from PubChem (CID 119006864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).