(4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone

C14H10N2O2 — CID 166063500

IUPAC(4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone
SMILESO=C(c1ccc(O)cc1)n1ccc2cccnc21
InChIInChI=1S/C14H10N2O2/c17-12-5-3-11(4-6-12)14(18)16-9-7-10-2-1-8-15-13(10)16/h1-9,17H
InChIKeyUQBWVKQHQMHUDW-UHFFFAOYSA-N
MW238.25 g/mol
LogP2.43
Rot. Bonds1

About (4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone

(4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone (PubChem CID 166063500) has the molecular formula C14H10N2O2 and a molecular weight of 238.25 g/mol. Its IUPAC name is (4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone.

Molecular Properties

Compound Name(4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone
PubChem CID166063500
Molecular FormulaC14H10N2O2
Molecular Weight238.25 g/mol
Exact Mass238.07
IUPAC Name(4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone
SMILESO=C(c1ccc(O)cc1)n1ccc2cccnc21
InChIInChI=1S/C14H10N2O2/c17-12-5-3-11(4-6-12)14(18)16-9-7-10-2-1-8-15-13(10)16/h1-9,17H
InChIKeyUQBWVKQHQMHUDW-UHFFFAOYSA-N
XLogP2.43
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone?
The IUPAC name of (4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone (CID 166063500) is (4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone.
What is the SMILES notation for (4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone?
The canonical SMILES for (4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone is O=C(c1ccc(O)cc1)n1ccc2cccnc21.
What is the InChIKey of (4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone?
The InChIKey is UQBWVKQHQMHUDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O2/c17-12-5-3-11(4-6-12)14(18)16-9-7-10-2-1-8-15-13(10)16/h1-9,17H.
What are the key properties of (4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone?
(4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone has a molecular weight of 238.25 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxyphenyl)-pyrrolo[2,3-b]pyridin-1-ylmethanone is sourced from PubChem (CID 166063500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).