3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine

C10H9BrN2 — CID 71222544

IUPAC3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine
SMILESBrc1c[nH]c2ccc(C3CC3)nc12
InChIInChI=1S/C10H9BrN2/c11-7-5-12-9-4-3-8(6-1-2-6)13-10(7)9/h3-6,12H,1-2H2
InChIKeyZUACFVGDXPLBRW-UHFFFAOYSA-N
MW237.10 g/mol
LogP3.20
Rot. Bonds1

About 3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine

3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine (PubChem CID 71222544) has the molecular formula C10H9BrN2 and a molecular weight of 237.10 g/mol. Its IUPAC name is 3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine
PubChem CID71222544
Molecular FormulaC10H9BrN2
Molecular Weight237.10 g/mol
Exact Mass235.99
IUPAC Name3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine
SMILESBrc1c[nH]c2ccc(C3CC3)nc12
InChIInChI=1S/C10H9BrN2/c11-7-5-12-9-4-3-8(6-1-2-6)13-10(7)9/h3-6,12H,1-2H2
InChIKeyZUACFVGDXPLBRW-UHFFFAOYSA-N
XLogP3.20
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.10
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-(6-cyclopropylpyrazin-2-yl)-3-iodo-1H-indole
CID 67959733
5-bromo-4,8-dichloro-2-cyclopropylquinoline
CID 63408960
5-bromo-3-cyclopropyl-1H-indole
CID 103863095
5-bromo-1H-pyrrolo[3,2-b]pyridine-3-carbaldehyde
CID 46856445
5-bromo-8-cyclopropylquinoxaline
CID 172993584
2-bromo-5-[3-(6-cyclopropylpyrazin-2-yl)-1H-indol-5-yl]-1,3,4-oxadiazole
CID 123617600
2-cyclopropyl-6,7-dihydro-5H-cyclopenta[b]pyridin-6-amine
CID 84654954
6,8-dibromo-4-chloro-2-cyclopropylquinoline
CID 63409162
2-piperidin-4-yl-8-(trifluoromethyl)quinoline
CID 70241298
2-chloro-6-cyclopropylpyridin-3-amine
CID 82597834
5,8-dibromo-2-cyclopropyl-N-ethylquinolin-4-amine
CID 63484561
3-bromo-6-methyl-1H-pyrrolo[3,2-b]pyridine-5-carboxylic acid
CID 138686935

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine?
The IUPAC name of 3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine (CID 71222544) is 3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine.
What is the SMILES notation for 3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine?
The canonical SMILES for 3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine is Brc1c[nH]c2ccc(C3CC3)nc12.
What is the InChIKey of 3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine?
The InChIKey is ZUACFVGDXPLBRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN2/c11-7-5-12-9-4-3-8(6-1-2-6)13-10(7)9/h3-6,12H,1-2H2.
What are the key properties of 3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine?
3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine has a molecular weight of 237.10 g/mol, XLogP of 3.20, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-cyclopropyl-1H-pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 71222544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).