6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine

C10H8BrN5 — CID 60731660

IUPAC6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine
SMILESCn1cc(-c2nc3ncc(Br)cc3[nH]2)cn1
InChIInChI=1S/C10H8BrN5/c1-16-5-6(3-13-16)9-14-8-2-7(11)4-12-10(8)15-9/h2-5H,1H3,(H,12,14,15)
InChIKeyRPQAZWBBZNPWLW-UHFFFAOYSA-N
MW278.11 g/mol
LogP2.12
Rot. Bonds1

About 6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine

6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine (PubChem CID 60731660) has the molecular formula C10H8BrN5 and a molecular weight of 278.11 g/mol. Its IUPAC name is 6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine
PubChem CID60731660
Molecular FormulaC10H8BrN5
Molecular Weight278.11 g/mol
Exact Mass277.00
IUPAC Name6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine
SMILESCn1cc(-c2nc3ncc(Br)cc3[nH]2)cn1
InChIInChI=1S/C10H8BrN5/c1-16-5-6(3-13-16)9-14-8-2-7(11)4-12-10(8)15-9/h2-5H,1H3,(H,12,14,15)
InChIKeyRPQAZWBBZNPWLW-UHFFFAOYSA-N
XLogP2.12
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.11
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine (CID 60731660) is 6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine is Cn1cc(-c2nc3ncc(Br)cc3[nH]2)cn1.
What is the InChIKey of 6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is RPQAZWBBZNPWLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN5/c1-16-5-6(3-13-16)9-14-8-2-7(11)4-12-10(8)15-9/h2-5H,1H3,(H,12,14,15).
What are the key properties of 6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine?
6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 278.11 g/mol, XLogP of 2.12, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 60731660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).