4-methylpyrrolo[3,2-b]pyridine;hydroiodide

C8H9IN2 — CID 131675074

IUPAC4-methylpyrrolo[3,2-b]pyridine;hydroiodide
SMILESCn1cccc2nccc1-2.I
InChIInChI=1S/C8H8N2.HI/c1-10-6-2-3-7-8(10)4-5-9-7;/h2-6H,1H3;1H
InChIKeyHOWWXDWKSAKDEA-UHFFFAOYSA-N
MW260.08 g/mol
LogP2.14
Rot. Bonds

About 4-methylpyrrolo[3,2-b]pyridine;hydroiodide

4-methylpyrrolo[3,2-b]pyridine;hydroiodide (PubChem CID 131675074) has the molecular formula C8H9IN2 and a molecular weight of 260.08 g/mol. Its IUPAC name is 4-methylpyrrolo[3,2-b]pyridine;hydroiodide.

Molecular Properties

Compound Name4-methylpyrrolo[3,2-b]pyridine;hydroiodide
PubChem CID131675074
Molecular FormulaC8H9IN2
Molecular Weight260.08 g/mol
Exact Mass259.98
IUPAC Name4-methylpyrrolo[3,2-b]pyridine;hydroiodide
SMILESCn1cccc2nccc1-2.I
InChIInChI=1S/C8H8N2.HI/c1-10-6-2-3-7-8(10)4-5-9-7;/h2-6H,1H3;1H
InChIKeyHOWWXDWKSAKDEA-UHFFFAOYSA-N
XLogP2.14
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.08
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-bromopyrrolo[3,2-b]pyridine
CID 141375457
4-ethylpyrrolo[3,2-b]pyridine
CID 167069876
4-methylimidazo[4,5-b]pyridine
CID 19964667
1-(1-methylpyrrol-2-yl)isoquinoline
CID 11769704
4,7-dimethylpyrrolo[3,2-b]pyridine
CID 91903080
methane;1-propan-2-ylimidazole;4-propan-2-ylpyrrolo[3,2-b]pyridine
CID 159677726
2-(1,4-dimethylpyrrol-2-yl)pyridine;ethane
CID 143140664
3-(1-methylpyrrol-2-yl)pyridine
CID 10249
dichloroosmium;bis(2-(1-methylimidazol-2-yl)pyridine)
CID 23534671
tris(2-pyridin-2-ylpyrrol-1-yl)borane
CID 153309075
2-(1-methyl-5-phenylimidazol-2-yl)pyridine
CID 53243377
2-[4-(1-methylpyrrol-2-yl)-6-(1,3-thiazol-2-yl)-2-pyridinyl]-1,3-thiazole
CID 132570576

Frequently Asked Questions

What is the IUPAC name of 4-methylpyrrolo[3,2-b]pyridine;hydroiodide?
The IUPAC name of 4-methylpyrrolo[3,2-b]pyridine;hydroiodide (CID 131675074) is 4-methylpyrrolo[3,2-b]pyridine;hydroiodide.
What is the SMILES notation for 4-methylpyrrolo[3,2-b]pyridine;hydroiodide?
The canonical SMILES for 4-methylpyrrolo[3,2-b]pyridine;hydroiodide is Cn1cccc2nccc1-2.I.
What is the InChIKey of 4-methylpyrrolo[3,2-b]pyridine;hydroiodide?
The InChIKey is HOWWXDWKSAKDEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2.HI/c1-10-6-2-3-7-8(10)4-5-9-7;/h2-6H,1H3;1H.
What are the key properties of 4-methylpyrrolo[3,2-b]pyridine;hydroiodide?
4-methylpyrrolo[3,2-b]pyridine;hydroiodide has a molecular weight of 260.08 g/mol, XLogP of 2.14, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylpyrrolo[3,2-b]pyridine;hydroiodide is sourced from PubChem (CID 131675074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).