4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine

C11H10BrN5 — CID 45485513

IUPAC4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine
SMILESCc1cc(-c2nccc3[nH]c(N)nc23)[nH]c1Br
InChIInChI=1S/C11H10BrN5/c1-5-4-7(15-10(5)12)8-9-6(2-3-14-8)16-11(13)17-9/h2-4,15H,1H3,(H3,13,16,17)
InChIKeyHUOCVLFPJPYQLT-UHFFFAOYSA-N
MW292.14 g/mol
LogP2.61
Rot. Bonds1

About 4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine

4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine (PubChem CID 45485513) has the molecular formula C11H10BrN5 and a molecular weight of 292.14 g/mol. Its IUPAC name is 4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine.

Molecular Properties

Compound Name4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine
PubChem CID45485513
Molecular FormulaC11H10BrN5
Molecular Weight292.14 g/mol
Exact Mass291.01
IUPAC Name4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine
SMILESCc1cc(-c2nccc3[nH]c(N)nc23)[nH]c1Br
InChIInChI=1S/C11H10BrN5/c1-5-4-7(15-10(5)12)8-9-6(2-3-14-8)16-11(13)17-9/h2-4,15H,1H3,(H3,13,16,17)
InChIKeyHUOCVLFPJPYQLT-UHFFFAOYSA-N
XLogP2.61
TPSA83.38 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.14
LogP ≤ 52.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine?
The IUPAC name of 4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine (CID 45485513) is 4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine.
What is the SMILES notation for 4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine?
The canonical SMILES for 4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine is Cc1cc(-c2nccc3[nH]c(N)nc23)[nH]c1Br.
What is the InChIKey of 4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine?
The InChIKey is HUOCVLFPJPYQLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrN5/c1-5-4-7(15-10(5)12)8-9-6(2-3-14-8)16-11(13)17-9/h2-4,15H,1H3,(H3,13,16,17).
What are the key properties of 4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine?
4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine has a molecular weight of 292.14 g/mol, XLogP of 2.61, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-bromo-4-methyl-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amine is sourced from PubChem (CID 45485513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).