6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine

C11H9ClIN3 — CID 115473632

IUPAC6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine
SMILESNc1ccc(Cl)nc1Nc1ccccc1I
InChIInChI=1S/C11H9ClIN3/c12-10-6-5-8(14)11(16-10)15-9-4-2-1-3-7(9)13/h1-6H,14H2,(H,15,16)
InChIKeyDPRGQIIZKSWEAV-UHFFFAOYSA-N
MW345.57 g/mol
LogP3.67
Rot. Bonds2

About 6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine

6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine (PubChem CID 115473632) has the molecular formula C11H9ClIN3 and a molecular weight of 345.57 g/mol. Its IUPAC name is 6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine
PubChem CID115473632
Molecular FormulaC11H9ClIN3
Molecular Weight345.57 g/mol
Exact Mass344.95
IUPAC Name6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine
SMILESNc1ccc(Cl)nc1Nc1ccccc1I
InChIInChI=1S/C11H9ClIN3/c12-10-6-5-8(14)11(16-10)15-9-4-2-1-3-7(9)13/h1-6H,14H2,(H,15,16)
InChIKeyDPRGQIIZKSWEAV-UHFFFAOYSA-N
XLogP3.67
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.57
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine
CID 115473651
6-chloro-2-N-pyridin-2-ylpyridine-2,3-diamine
CID 53486868
6-chloro-2-N-isoquinolin-8-ylpyridine-2,3-diamine
CID 115474338
4-N-(2-iodophenyl)pyrimidine-4,5-diamine
CID 79918939
6-chloro-2-N-(2,4-difluorophenyl)pyridine-2,3-diamine
CID 113316733
6-chloro-2-N-(5-chloroquinolin-8-yl)pyridine-2,3-diamine
CID 116783040
2-[(3-amino-6-chloro-2-pyridinyl)amino]-4-chlorobenzonitrile
CID 115474241
3-chloro-1-N-(2-iodophenyl)benzene-1,2-diamine
CID 104834035
4-chloro-N-(2-iodophenyl)phthalazin-1-amine
CID 55221849
2-N-(5-bromo-4-fluoro-2-methylphenyl)-6-chloropyridine-2,3-diamine
CID 107591031
6-chloro-2-N-(2,6-dichloro-4-fluorophenyl)pyridine-2,3-diamine
CID 83076459
3-[(3-amino-6-chloro-2-pyridinyl)amino]-4-methylbenzonitrile
CID 115474055

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine?
The IUPAC name of 6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine (CID 115473632) is 6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine.
What is the SMILES notation for 6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine?
The canonical SMILES for 6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine is Nc1ccc(Cl)nc1Nc1ccccc1I.
What is the InChIKey of 6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine?
The InChIKey is DPRGQIIZKSWEAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClIN3/c12-10-6-5-8(14)11(16-10)15-9-4-2-1-3-7(9)13/h1-6H,14H2,(H,15,16).
What are the key properties of 6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine?
6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine has a molecular weight of 345.57 g/mol, XLogP of 3.67, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine is sourced from PubChem (CID 115473632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).