cyclopenta[c]pyridin-6-one;hydrobromide

C8H6BrNO — CID 70110478

IUPACcyclopenta[c]pyridin-6-one;hydrobromide
SMILESBr.O=C1C=c2ccncc2=C1
InChIInChI=1S/C8H5NO.BrH/c10-8-3-6-1-2-9-5-7(6)4-8;/h1-5H;1H
InChIKeySYSPQRJMZIJPOE-UHFFFAOYSA-N
MW212.05 g/mol
LogP-0.20
Rot. Bonds

About cyclopenta[c]pyridin-6-one;hydrobromide

cyclopenta[c]pyridin-6-one;hydrobromide (PubChem CID 70110478) has the molecular formula C8H6BrNO and a molecular weight of 212.05 g/mol. Its IUPAC name is cyclopenta[c]pyridin-6-one;hydrobromide.

Molecular Properties

Compound Namecyclopenta[c]pyridin-6-one;hydrobromide
PubChem CID70110478
Molecular FormulaC8H6BrNO
Molecular Weight212.05 g/mol
Exact Mass210.96
IUPAC Namecyclopenta[c]pyridin-6-one;hydrobromide
SMILESBr.O=C1C=c2ccncc2=C1
InChIInChI=1S/C8H5NO.BrH/c10-8-3-6-1-2-9-5-7(6)4-8;/h1-5H;1H
InChIKeySYSPQRJMZIJPOE-UHFFFAOYSA-N
XLogP-0.20
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.05
LogP ≤ 5-0.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopenta[c]pyridin-6-one;hydrobromide?
The IUPAC name of cyclopenta[c]pyridin-6-one;hydrobromide (CID 70110478) is cyclopenta[c]pyridin-6-one;hydrobromide.
What is the SMILES notation for cyclopenta[c]pyridin-6-one;hydrobromide?
The canonical SMILES for cyclopenta[c]pyridin-6-one;hydrobromide is Br.O=C1C=c2ccncc2=C1.
What is the InChIKey of cyclopenta[c]pyridin-6-one;hydrobromide?
The InChIKey is SYSPQRJMZIJPOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5NO.BrH/c10-8-3-6-1-2-9-5-7(6)4-8;/h1-5H;1H.
What are the key properties of cyclopenta[c]pyridin-6-one;hydrobromide?
cyclopenta[c]pyridin-6-one;hydrobromide has a molecular weight of 212.05 g/mol, XLogP of -0.20, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta[c]pyridin-6-one;hydrobromide is sourced from PubChem (CID 70110478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).