2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine

C6H4ClF2IN2 — CID 130102506

IUPAC2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine
SMILESNc1c(I)cc(C(F)F)nc1Cl
InChIInChI=1S/C6H4ClF2IN2/c7-5-4(11)2(10)1-3(12-5)6(8)9/h1,6H,11H2
InChIKeyJIROOQOLQOLTTE-UHFFFAOYSA-N
MW304.47 g/mol
LogP2.86
Rot. Bonds1

About 2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine

2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine (PubChem CID 130102506) has the molecular formula C6H4ClF2IN2 and a molecular weight of 304.47 g/mol. Its IUPAC name is 2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine.

Molecular Properties

Compound Name2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine
PubChem CID130102506
Molecular FormulaC6H4ClF2IN2
Molecular Weight304.47 g/mol
Exact Mass303.91
IUPAC Name2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine
SMILESNc1c(I)cc(C(F)F)nc1Cl
InChIInChI=1S/C6H4ClF2IN2/c7-5-4(11)2(10)1-3(12-5)6(8)9/h1,6H,11H2
InChIKeyJIROOQOLQOLTTE-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

3-chloro-6-(difluoromethyl)-4-iodopyridin-2-amine
CID 118996077
4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-amine
CID 130102646
2,4-dichloro-6-(difluoromethyl)-3-iodopyridine
CID 119020457
3-chloro-6-(difluoromethyl)-2-iodopyridin-4-amine
CID 130102520
ethyl 3-amino-2-chloro-6-(difluoromethyl)pyridine-4-carboxylate
CID 134671239
2-amino-6-(difluoromethyl)-4-iodopyridine-3-carbaldehyde
CID 119020004
6-(difluoromethyl)-3-fluoro-2,4-diiodopyridine
CID 130100479
2-chloro-6-(difluoromethyl)-3-iodopyridine-4-carboxylic acid
CID 119024451
4-amino-2-chloro-6-(difluoromethyl)pyridine-3-sulfonamide
CID 130103127
3-bromo-6-(difluoromethyl)-2,4-diiodopyridine
CID 130100414
[6-(difluoromethyl)-3-fluoro-4-iodo-2-pyridinyl]methanamine
CID 118820195
[6-(difluoromethyl)-2-fluoro-4-iodo-3-pyridinyl]methanamine
CID 130079991

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine?
The IUPAC name of 2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine (CID 130102506) is 2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine.
What is the SMILES notation for 2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine?
The canonical SMILES for 2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine is Nc1c(I)cc(C(F)F)nc1Cl.
What is the InChIKey of 2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine?
The InChIKey is JIROOQOLQOLTTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4ClF2IN2/c7-5-4(11)2(10)1-3(12-5)6(8)9/h1,6H,11H2.
What are the key properties of 2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine?
2-chloro-6-(difluoromethyl)-4-iodopyridin-3-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 2-chloro-6-(difluoromethyl)-4-iodopyridin-3-amine is sourced from PubChem (CID 130102506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).