1H-pyrrolo[2,3-b]pyridin-3-ylmethanol

C8H8N2O — CID 43156197

IUPAC1H-pyrrolo[2,3-b]pyridin-3-ylmethanol
SMILESOCc1c[nH]c2ncccc12
InChIInChI=1S/C8H8N2O/c11-5-6-4-10-8-7(6)2-1-3-9-8/h1-4,11H,5H2,(H,9,10)
InChIKeyVWPSBHFXPGWHDI-UHFFFAOYSA-N
MW148.16 g/mol
LogP1.06
Rot. Bonds1

About 1H-pyrrolo[2,3-b]pyridin-3-ylmethanol

1H-pyrrolo[2,3-b]pyridin-3-ylmethanol (PubChem CID 43156197) has the molecular formula C8H8N2O and a molecular weight of 148.16 g/mol. Its IUPAC name is 1H-pyrrolo[2,3-b]pyridin-3-ylmethanol.

Molecular Properties

Compound Name1H-pyrrolo[2,3-b]pyridin-3-ylmethanol
PubChem CID43156197
Molecular FormulaC8H8N2O
Molecular Weight148.16 g/mol
Exact Mass148.06
IUPAC Name1H-pyrrolo[2,3-b]pyridin-3-ylmethanol
SMILESOCc1c[nH]c2ncccc12
InChIInChI=1S/C8H8N2O/c11-5-6-4-10-8-7(6)2-1-3-9-8/h1-4,11H,5H2,(H,9,10)
InChIKeyVWPSBHFXPGWHDI-UHFFFAOYSA-N
XLogP1.06
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1H-pyrrolo[2,3-b]pyridin-3-ylmethanol?
The IUPAC name of 1H-pyrrolo[2,3-b]pyridin-3-ylmethanol (CID 43156197) is 1H-pyrrolo[2,3-b]pyridin-3-ylmethanol.
What is the SMILES notation for 1H-pyrrolo[2,3-b]pyridin-3-ylmethanol?
The canonical SMILES for 1H-pyrrolo[2,3-b]pyridin-3-ylmethanol is OCc1c[nH]c2ncccc12.
What is the InChIKey of 1H-pyrrolo[2,3-b]pyridin-3-ylmethanol?
The InChIKey is VWPSBHFXPGWHDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O/c11-5-6-4-10-8-7(6)2-1-3-9-8/h1-4,11H,5H2,(H,9,10).
What are the key properties of 1H-pyrrolo[2,3-b]pyridin-3-ylmethanol?
1H-pyrrolo[2,3-b]pyridin-3-ylmethanol has a molecular weight of 148.16 g/mol, XLogP of 1.06, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-pyrrolo[2,3-b]pyridin-3-ylmethanol is sourced from PubChem (CID 43156197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).