4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine

C8H7Cl2N3 — CID 163273340

IUPAC4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine
SMILESCc1nc2c(Cl)nc(Cl)cc2n1C
InChIInChI=1S/C8H7Cl2N3/c1-4-11-7-5(13(4)2)3-6(9)12-8(7)10/h3H,1-2H3
InChIKeyYCAFVTDCYUYHSF-UHFFFAOYSA-N
MW216.07 g/mol
LogP2.58
Rot. Bonds

About 4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine

4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine (PubChem CID 163273340) has the molecular formula C8H7Cl2N3 and a molecular weight of 216.07 g/mol. Its IUPAC name is 4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine
PubChem CID163273340
Molecular FormulaC8H7Cl2N3
Molecular Weight216.07 g/mol
Exact Mass215.00
IUPAC Name4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine
SMILESCc1nc2c(Cl)nc(Cl)cc2n1C
InChIInChI=1S/C8H7Cl2N3/c1-4-11-7-5(13(4)2)3-6(9)12-8(7)10/h3H,1-2H3
InChIKeyYCAFVTDCYUYHSF-UHFFFAOYSA-N
XLogP2.58
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.07
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

5,6-Dichloro-1,2-dimethylbenzimidazole
CID 840715
1-methyl-1H-imidazo(4,5-c)pyridine
CID 12299352
1H-Benzimidazole, 5-chloro-1-ethyl-2-methyl-
CID 76064
1H-Benzimidazole, 5,6-dichloro-1-ethyl-2-methyl-
CID 76717
5-Chloro-1,2-dimethyl-1H-benzimidazole
CID 13032420
4,6-dichloro-1H-imidazo[4,5-c]pyridine
CID 5358562
3-methyl-3H-imidazo(4,5-c)pyridine
CID 12299354
6-Chloro-1-methyl-1H-imidazo[4,5-c]pyridine
CID 13032381
5-(2,5-Dichloropyrimidin-4-yl)pyrrolo[3,2-d]pyrimidine
CID 164575900
6-chloro-1,2-dimethyl-1H-benzo[d]imidazole
CID 315498
1-Methyl-2-(trifluoromethyl)-6-chloro-1H-benzimidazole
CID 10331616
5-Chloro-1-methyl-2-(trifluoromethyl)benzimidazole
CID 10354027

Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine?
The IUPAC name of 4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine (CID 163273340) is 4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine.
What is the SMILES notation for 4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine?
The canonical SMILES for 4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine is Cc1nc2c(Cl)nc(Cl)cc2n1C.
What is the InChIKey of 4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine?
The InChIKey is YCAFVTDCYUYHSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7Cl2N3/c1-4-11-7-5(13(4)2)3-6(9)12-8(7)10/h3H,1-2H3.
What are the key properties of 4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine?
4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine has a molecular weight of 216.07 g/mol, XLogP of 2.58, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-1,2-dimethylimidazo[4,5-c]pyridine is sourced from PubChem (CID 163273340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).