(3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium

C6H3ClIN2+ — CID 163542048

IUPAC(3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium
SMILESC#[N+]c1nccc(I)c1Cl
InChIInChI=1S/C6H3ClIN2/c1-9-6-5(7)4(8)2-3-10-6/h1-3H/q+1
InChIKeyFUXUFTKUDFJGBM-UHFFFAOYSA-N
MW265.46 g/mol
LogP2.93
Rot. Bonds

About (3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium

(3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium (PubChem CID 163542048) has the molecular formula C6H3ClIN2+ and a molecular weight of 265.46 g/mol. Its IUPAC name is (3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium.

Molecular Properties

Compound Name(3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium
PubChem CID163542048
Molecular FormulaC6H3ClIN2+
Molecular Weight265.46 g/mol
Exact Mass264.90
IUPAC Name(3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium
SMILESC#[N+]c1nccc(I)c1Cl
InChIInChI=1S/C6H3ClIN2/c1-9-6-5(7)4(8)2-3-10-6/h1-3H/q+1
InChIKeyFUXUFTKUDFJGBM-UHFFFAOYSA-N
XLogP2.93
TPSA17.25 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.46
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3-chloro-4-iodo-2-pyridinyl) carbamate
CID 175563884
4-iodo-3-(2,3,4,5,6-pentachlorophenyl)-2-(trifluoromethyl)pyridine
CID 134628304
2-(3-chloro-4-iodo-2-pyridinyl)-2-methylpropanenitrile
CID 155858637
3-tert-butyl-2-chloro-4-iodopyridine
CID 170927474
5-chloro-6-iodo-1,10-phenanthroline
CID 163214528
4-chloro-5-iodo-1H-benzimidazole
CID 130951078
5-chloro-7-iodoquinolin-8-olate
CID 149159528
cerium(4+);tetrakis(5-chloro-7-iodoquinolin-8-olate)
CID 72708331
bis(5-chloro-7-iodoquinolin-8-ol);indium-111(3+)
CID 25009411
2-fluoro-4-iodo-3-(2,3,5-trichlorophenyl)pyridine
CID 134637480
bis(5-chloro-7-iodoquinolin-8-ol);gallium-67(3+)
CID 25009413
2-[1-(3-chloro-4-iodo-2-pyridinyl)azetidin-3-yl]propan-2-ol
CID 166914909

Frequently Asked Questions

What is the IUPAC name of (3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium?
The IUPAC name of (3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium (CID 163542048) is (3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium.
What is the SMILES notation for (3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium?
The canonical SMILES for (3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium is C#[N+]c1nccc(I)c1Cl.
What is the InChIKey of (3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium?
The InChIKey is FUXUFTKUDFJGBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3ClIN2/c1-9-6-5(7)4(8)2-3-10-6/h1-3H/q+1.
What are the key properties of (3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium?
(3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium has a molecular weight of 265.46 g/mol, XLogP of 2.93, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-4-iodo-2-pyridinyl)-methylidyneazanium is sourced from PubChem (CID 163542048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).