6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine

C12H13BrN2 — CID 138986129

IUPAC6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine
SMILESBrc1cnc2ccn(C3CCCC3)c2c1
InChIInChI=1S/C12H13BrN2/c13-9-7-12-11(14-8-9)5-6-15(12)10-3-1-2-4-10/h5-8,10H,1-4H2
InChIKeyCONNOLTVWQXZIL-UHFFFAOYSA-N
MW265.15 g/mol
LogP3.91
Rot. Bonds1

About 6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine

6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine (PubChem CID 138986129) has the molecular formula C12H13BrN2 and a molecular weight of 265.15 g/mol. Its IUPAC name is 6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine
PubChem CID138986129
Molecular FormulaC12H13BrN2
Molecular Weight265.15 g/mol
Exact Mass264.03
IUPAC Name6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine
SMILESBrc1cnc2ccn(C3CCCC3)c2c1
InChIInChI=1S/C12H13BrN2/c13-9-7-12-11(14-8-9)5-6-15(12)10-3-1-2-4-10/h5-8,10H,1-4H2
InChIKeyCONNOLTVWQXZIL-UHFFFAOYSA-N
XLogP3.91
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.15
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-bromo-1-methylsulfonylpyrrolo[3,2-b]pyridine
CID 118249224
6-bromo-1-[(2S)-oxan-2-yl]pyrazolo[4,5-b]pyridine
CID 124518404
N-(6-bromopyrrolo[3,2-b]pyridin-1-yl)-1-phenylmethanimine
CID 67459369
4-(6-bromobenzimidazol-1-yl)thiane 1-oxide
CID 139394841
6-chloro-1-cyclobutylbenzimidazole
CID 126553044
1-cyclopentyl-5,6-dimethylbenzimidazole
CID 115900464
5-bromo-1-cyclopropylbenzimidazole
CID 82496945
6-bromo-2-(1-chloroethyl)-3-cycloheptylimidazo[4,5-b]pyridine
CID 79302816
2-(6-bromopyrrolo[3,2-b]pyridin-1-yl)-N,N-dimethylacetamide
CID 138319734
8-(3-cyclohexylbenzimidazol-5-yl)imidazo[1,2-a]pyrazine
CID 155812064
5-bromo-1-[4-(methoxymethyl)cyclohexyl]pyrrolo[2,3-b]pyridine
CID 176562674
6-bromo-3-cyclobutylimidazo[4,5-b]pyridin-2-amine
CID 79306648

Frequently Asked Questions

What is the IUPAC name of 6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine?
The IUPAC name of 6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine (CID 138986129) is 6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine.
What is the SMILES notation for 6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine?
The canonical SMILES for 6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine is Brc1cnc2ccn(C3CCCC3)c2c1.
What is the InChIKey of 6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine?
The InChIKey is CONNOLTVWQXZIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13BrN2/c13-9-7-12-11(14-8-9)5-6-15(12)10-3-1-2-4-10/h5-8,10H,1-4H2.
What are the key properties of 6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine?
6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine has a molecular weight of 265.15 g/mol, XLogP of 3.91, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-1-cyclopentylpyrrolo[3,2-b]pyridine is sourced from PubChem (CID 138986129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).