1-(1H-indazol-4-yl)-2-phenylethanol

C15H14N2O — CID 155558792

IUPAC1-(1H-indazol-4-yl)-2-phenylethanol
SMILESOC(Cc1ccccc1)c1cccc2[nH]ncc12
InChIInChI=1S/C15H14N2O/c18-15(9-11-5-2-1-3-6-11)12-7-4-8-14-13(12)10-16-17-14/h1-8,10,15,18H,9H2,(H,16,17)
InChIKeyNMBJPMWZRMOLSC-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.84
Rot. Bonds3

About 1-(1H-indazol-4-yl)-2-phenylethanol

1-(1H-indazol-4-yl)-2-phenylethanol (PubChem CID 155558792) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 1-(1H-indazol-4-yl)-2-phenylethanol.

Molecular Properties

Compound Name1-(1H-indazol-4-yl)-2-phenylethanol
PubChem CID155558792
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name1-(1H-indazol-4-yl)-2-phenylethanol
SMILESOC(Cc1ccccc1)c1cccc2[nH]ncc12
InChIInChI=1S/C15H14N2O/c18-15(9-11-5-2-1-3-6-11)12-7-4-8-14-13(12)10-16-17-14/h1-8,10,15,18H,9H2,(H,16,17)
InChIKeyNMBJPMWZRMOLSC-UHFFFAOYSA-N
XLogP2.84
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-indazol-4-yl)-2-phenylethanol?
The IUPAC name of 1-(1H-indazol-4-yl)-2-phenylethanol (CID 155558792) is 1-(1H-indazol-4-yl)-2-phenylethanol.
What is the SMILES notation for 1-(1H-indazol-4-yl)-2-phenylethanol?
The canonical SMILES for 1-(1H-indazol-4-yl)-2-phenylethanol is OC(Cc1ccccc1)c1cccc2[nH]ncc12.
What is the InChIKey of 1-(1H-indazol-4-yl)-2-phenylethanol?
The InChIKey is NMBJPMWZRMOLSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c18-15(9-11-5-2-1-3-6-11)12-7-4-8-14-13(12)10-16-17-14/h1-8,10,15,18H,9H2,(H,16,17).
What are the key properties of 1-(1H-indazol-4-yl)-2-phenylethanol?
1-(1H-indazol-4-yl)-2-phenylethanol has a molecular weight of 238.29 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indazol-4-yl)-2-phenylethanol is sourced from PubChem (CID 155558792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).