pyrrolo[2,3-b]pyridin-2-one;hydrochloride

C7H5ClN2O — CID 174216202

IUPACpyrrolo[2,3-b]pyridin-2-one;hydrochloride
SMILESCl.O=C1C=c2cccnc2=N1
InChIInChI=1S/C7H4N2O.ClH/c10-6-4-5-2-1-3-8-7(5)9-6;/h1-4H;1H
InChIKeyYOWOFFVGGBMVTC-UHFFFAOYSA-N
MW168.58 g/mol
LogP-0.56
Rot. Bonds

About pyrrolo[2,3-b]pyridin-2-one;hydrochloride

pyrrolo[2,3-b]pyridin-2-one;hydrochloride (PubChem CID 174216202) has the molecular formula C7H5ClN2O and a molecular weight of 168.58 g/mol. Its IUPAC name is pyrrolo[2,3-b]pyridin-2-one;hydrochloride.

Molecular Properties

Compound Namepyrrolo[2,3-b]pyridin-2-one;hydrochloride
PubChem CID174216202
Molecular FormulaC7H5ClN2O
Molecular Weight168.58 g/mol
Exact Mass168.01
IUPAC Namepyrrolo[2,3-b]pyridin-2-one;hydrochloride
SMILESCl.O=C1C=c2cccnc2=N1
InChIInChI=1S/C7H4N2O.ClH/c10-6-4-5-2-1-3-8-7(5)9-6;/h1-4H;1H
InChIKeyYOWOFFVGGBMVTC-UHFFFAOYSA-N
XLogP-0.56
TPSA42.32 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.58
LogP ≤ 5-0.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of pyrrolo[2,3-b]pyridin-2-one;hydrochloride?
The IUPAC name of pyrrolo[2,3-b]pyridin-2-one;hydrochloride (CID 174216202) is pyrrolo[2,3-b]pyridin-2-one;hydrochloride.
What is the SMILES notation for pyrrolo[2,3-b]pyridin-2-one;hydrochloride?
The canonical SMILES for pyrrolo[2,3-b]pyridin-2-one;hydrochloride is Cl.O=C1C=c2cccnc2=N1.
What is the InChIKey of pyrrolo[2,3-b]pyridin-2-one;hydrochloride?
The InChIKey is YOWOFFVGGBMVTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4N2O.ClH/c10-6-4-5-2-1-3-8-7(5)9-6;/h1-4H;1H.
What are the key properties of pyrrolo[2,3-b]pyridin-2-one;hydrochloride?
pyrrolo[2,3-b]pyridin-2-one;hydrochloride has a molecular weight of 168.58 g/mol, XLogP of -0.56, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyrrolo[2,3-b]pyridin-2-one;hydrochloride is sourced from PubChem (CID 174216202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).