[2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol

C14H11FN2O — CID 95849492

IUPAC[2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol
SMILESOCc1c(-c2ccc(F)cc2)[nH]c2ncccc12
InChIInChI=1S/C14H11FN2O/c15-10-5-3-9(4-6-10)13-12(8-18)11-2-1-7-16-14(11)17-13/h1-7,18H,8H2,(H,16,17)
InChIKeyUFCMOWVJYKDCHR-UHFFFAOYSA-N
MW242.25 g/mol
LogP2.86
Rot. Bonds2

About [2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol

[2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol (PubChem CID 95849492) has the molecular formula C14H11FN2O and a molecular weight of 242.25 g/mol. Its IUPAC name is [2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol.

Molecular Properties

Compound Name[2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol
PubChem CID95849492
Molecular FormulaC14H11FN2O
Molecular Weight242.25 g/mol
Exact Mass242.09
IUPAC Name[2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol
SMILESOCc1c(-c2ccc(F)cc2)[nH]c2ncccc12
InChIInChI=1S/C14H11FN2O/c15-10-5-3-9(4-6-10)13-12(8-18)11-2-1-7-16-14(11)17-13/h1-7,18H,8H2,(H,16,17)
InChIKeyUFCMOWVJYKDCHR-UHFFFAOYSA-N
XLogP2.86
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.25
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol?
The IUPAC name of [2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol (CID 95849492) is [2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol.
What is the SMILES notation for [2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol?
The canonical SMILES for [2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol is OCc1c(-c2ccc(F)cc2)[nH]c2ncccc12.
What is the InChIKey of [2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol?
The InChIKey is UFCMOWVJYKDCHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O/c15-10-5-3-9(4-6-10)13-12(8-18)11-2-1-7-16-14(11)17-13/h1-7,18H,8H2,(H,16,17).
What are the key properties of [2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol?
[2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol has a molecular weight of 242.25 g/mol, XLogP of 2.86, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanol is sourced from PubChem (CID 95849492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).