4-hydroxy-1-phenylindazole-6-carbonitrile

Name: 4-hydroxy-1-phenylindazole-6-carbonitrile — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₄H₉N₃O — CID 151204276

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC4-hydroxy-1-phenylindazole-6-carbonitrile

SMILESN#Cc1cc(O)c2cnn(-c3ccccc3)c2c1

InChIInChI=1S/C14H9N3O/c15-8-10-6-13-12(14(18)7-10)9-16-17(13)11-4-2-1-3-5-11/h1-7,9,18H

InChIKeyNIYIISYOIQMDGE-UHFFFAOYSA-N

MW235.25 g/mol

LogP2.60

Rot. Bonds1

About 4-hydroxy-1-phenylindazole-6-carbonitrile

4-hydroxy-1-phenylindazole-6-carbonitrile (PubChem CID 151204276) has the molecular formula C₁₄H₉N₃O and a molecular weight of 235.25 g/mol. Its IUPAC name is 4-hydroxy-1-phenylindazole-6-carbonitrile.

Molecular Properties

Compound Name	4-hydroxy-1-phenylindazole-6-carbonitrile
PubChem CID	151204276
Molecular Formula	C₁₄H₉N₃O
Molecular Weight	235.25 g/mol
Exact Mass	235.07
IUPAC Name	4-hydroxy-1-phenylindazole-6-carbonitrile
SMILES	N#Cc1cc(O)c2cnn(-c3ccccc3)c2c1
InChI	InChI=1S/C14H9N3O/c15-8-10-6-13-12(14(18)7-10)9-16-17(13)11-4-2-1-3-5-11/h1-7,9,18H
InChIKey	NIYIISYOIQMDGE-UHFFFAOYSA-N
XLogP	2.60
TPSA	61.84 Å²
H-Bond Donors	1
H-Bond Acceptors	4
Rotatable Bonds	1
Heavy Atoms	18
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	235.25
LogP ≤ 5	2.60
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-phenylindazole-6-carbonitrile?

The IUPAC name of 4-hydroxy-1-phenylindazole-6-carbonitrile (CID 151204276) is 4-hydroxy-1-phenylindazole-6-carbonitrile.

What is the SMILES notation for 4-hydroxy-1-phenylindazole-6-carbonitrile?

The canonical SMILES for 4-hydroxy-1-phenylindazole-6-carbonitrile is N#Cc1cc(O)c2cnn(-c3ccccc3)c2c1.

What is the InChIKey of 4-hydroxy-1-phenylindazole-6-carbonitrile?

The InChIKey is NIYIISYOIQMDGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9N3O/c15-8-10-6-13-12(14(18)7-10)9-16-17(13)11-4-2-1-3-5-11/h1-7,9,18H.

What are the key properties of 4-hydroxy-1-phenylindazole-6-carbonitrile?

4-hydroxy-1-phenylindazole-6-carbonitrile has a molecular weight of 235.25 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 4-hydroxy-1-phenylindazole-6-carbonitrile is sourced from PubChem (CID 151204276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 151204276 — identifiers, structure, computed properties (public domain)

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