6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine

C12H10BrN3 — CID 83170739

IUPAC6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine
SMILESCc1cc(Br)cn2cc(-c3ccc[nH]3)nc12
InChIInChI=1S/C12H10BrN3/c1-8-5-9(13)6-16-7-11(15-12(8)16)10-3-2-4-14-10/h2-7,14H,1H3
InChIKeyRVJPRSGKEZZDGC-UHFFFAOYSA-N
MW276.14 g/mol
LogP3.40
Rot. Bonds1

About 6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine

6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine (PubChem CID 83170739) has the molecular formula C12H10BrN3 and a molecular weight of 276.14 g/mol. Its IUPAC name is 6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine
PubChem CID83170739
Molecular FormulaC12H10BrN3
Molecular Weight276.14 g/mol
Exact Mass275.01
IUPAC Name6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine
SMILESCc1cc(Br)cn2cc(-c3ccc[nH]3)nc12
InChIInChI=1S/C12H10BrN3/c1-8-5-9(13)6-16-7-11(15-12(8)16)10-3-2-4-14-10/h2-7,14H,1H3
InChIKeyRVJPRSGKEZZDGC-UHFFFAOYSA-N
XLogP3.40
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.14
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine (CID 83170739) is 6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine is Cc1cc(Br)cn2cc(-c3ccc[nH]3)nc12.
What is the InChIKey of 6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine?
The InChIKey is RVJPRSGKEZZDGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrN3/c1-8-5-9(13)6-16-7-11(15-12(8)16)10-3-2-4-14-10/h2-7,14H,1H3.
What are the key properties of 6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine?
6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine has a molecular weight of 276.14 g/mol, XLogP of 3.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-methyl-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 83170739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).