6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine

C14H9Cl2IN4 — CID 159050239

IUPAC6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine
SMILESClc1ccc2c(I)ncn2c1.Clc1ccc2cncn2c1
InChIInChI=1S/C7H4ClIN2.C7H5ClN2/c8-5-1-2-6-7(9)10-4-11(6)3-5;8-6-1-2-7-3-9-5-10(7)4-6/h1-4H;1-5H
InChIKeyJXECKYMAIGSTSU-UHFFFAOYSA-N
MW431.06 g/mol
LogP4.58
Rot. Bonds

About 6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine

6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine (PubChem CID 159050239) has the molecular formula C14H9Cl2IN4 and a molecular weight of 431.06 g/mol. Its IUPAC name is 6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine
PubChem CID159050239
Molecular FormulaC14H9Cl2IN4
Molecular Weight431.06 g/mol
Exact Mass429.92
IUPAC Name6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine
SMILESClc1ccc2c(I)ncn2c1.Clc1ccc2cncn2c1
InChIInChI=1S/C7H4ClIN2.C7H5ClN2/c8-5-1-2-6-7(9)10-4-11(6)3-5;8-6-1-2-7-3-9-5-10(7)4-6/h1-4H;1-5H
InChIKeyJXECKYMAIGSTSU-UHFFFAOYSA-N
XLogP4.58
TPSA34.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.06
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-(3-methylbutan-2-yl)imidazo[1,5-a]pyridine
CID 149283120
8-bromo-6-chloroimidazo[1,5-a]pyridine
CID 118989006
2,4-difluoro-3-(1-iodoimidazo[1,5-a]pyrazin-6-yl)aniline
CID 164594670
6-(methoxymethyl)imidazo[1,5-a]pyridine
CID 163920431
6-thiophen-2-ylimidazo[1,5-a]pyridine
CID 117001237
6-chloro-3-(2,2-dimethylpropyl)imidazo[1,5-a]pyridine
CID 117139725
8-chloro-6-phenylimidazo[1,5-a]pyrazine
CID 76849768
2-imidazo[1,5-a]pyridin-6-ylpropan-1-amine
CID 83874457
1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone
CID 154727621
6-(pyrrolidin-1-ylmethyl)imidazo[1,5-a]pyridine
CID 169206193
6-chloro-1-iodo-3-[(2,3,6-trifluorophenyl)methyl]imidazo[1,5-a]pyridine
CID 70983333
2-(6-chloroimidazo[1,5-a]pyridin-3-yl)ethanamine
CID 83869580

Frequently Asked Questions

What is the IUPAC name of 6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine?
The IUPAC name of 6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine (CID 159050239) is 6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine.
What is the SMILES notation for 6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine?
The canonical SMILES for 6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine is Clc1ccc2c(I)ncn2c1.Clc1ccc2cncn2c1.
What is the InChIKey of 6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine?
The InChIKey is JXECKYMAIGSTSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4ClIN2.C7H5ClN2/c8-5-1-2-6-7(9)10-4-11(6)3-5;8-6-1-2-7-3-9-5-10(7)4-6/h1-4H;1-5H.
What are the key properties of 6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine?
6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine has a molecular weight of 431.06 g/mol, XLogP of 4.58, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloroimidazo[1,5-a]pyridine;6-chloro-1-iodoimidazo[1,5-a]pyridine is sourced from PubChem (CID 159050239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).