4-hydroxy-1-phenylindazole-6-carbonitrile

C14H9N3O — CID 151204276

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 Name4-hydroxy-1-phenylindazole-6-carbonitrile
PubChem CID151204276
Molecular FormulaC14H9N3O
Molecular Weight235.25 g/mol
Exact Mass235.07
IUPAC Name4-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
XLogP2.60
TPSA61.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-deuterio-1-(3-fluoro-4-phenylmethoxyphenyl)-4-hydroxyindazole-6-carbonitrile
CID 137153035
4-bromo-1-(3,5-difluoro-4-phenylmethoxyphenyl)indazole-6-carbonitrile
CID 67245855
5-amino-4-chloro-2-phenylpyridazin-3-one;3,5-dibromo-4-hydroxybenzonitrile
CID 174814217
4-bromo-5-methyl-1-phenylindazole
CID 74888869
5-chloro-1-phenylpyrazol-4-ol
CID 117232897
6-chloro-1-(3-fluoro-4-hydroxyphenyl)indazol-4-ol
CID 135910362
4-[1-[(6-bromo-3-pyridinyl)methylamino]ethenyl]-1-(4-fluorophenyl)indazole-6-carbonitrile
CID 143887690
4-[(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)oxymethyl]benzonitrile
CID 2478656
N-[4-(4-cyanophenoxy)-2-methylphenyl]-5-methyl-1-phenylpyrazole-4-carboxamide
CID 60578238
4-(1-phenylindazol-3-yl)benzonitrile
CID 57379769
4-[(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)sulfanylmethyl]benzonitrile
CID 16507685
N-(3-cyanophenyl)-5-methyl-1-phenyl-N-propan-2-ylpyrazole-4-carboxamide
CID 60615240

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).