3-cycloheptyl-2H-indazol-7-ol

C14H18N2O — CID 105488343

IUPAC3-cycloheptyl-2H-indazol-7-ol
SMILESOc1cccc2c(C3CCCCCC3)[nH]nc12
InChIInChI=1S/C14H18N2O/c17-12-9-5-8-11-13(15-16-14(11)12)10-6-3-1-2-4-7-10/h5,8-10,17H,1-4,6-7H2,(H,15,16)
InChIKeyDUDJIDLTEUYJDW-UHFFFAOYSA-N
MW230.31 g/mol
LogP3.71
Rot. Bonds1

About 3-cycloheptyl-2H-indazol-7-ol

3-cycloheptyl-2H-indazol-7-ol (PubChem CID 105488343) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-cycloheptyl-2H-indazol-7-ol.

Molecular Properties

Compound Name3-cycloheptyl-2H-indazol-7-ol
PubChem CID105488343
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name3-cycloheptyl-2H-indazol-7-ol
SMILESOc1cccc2c(C3CCCCCC3)[nH]nc12
InChIInChI=1S/C14H18N2O/c17-12-9-5-8-11-13(15-16-14(11)12)10-6-3-1-2-4-7-10/h5,8-10,17H,1-4,6-7H2,(H,15,16)
InChIKeyDUDJIDLTEUYJDW-UHFFFAOYSA-N
XLogP3.71
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cycloheptyl-2H-indazol-7-ol?
The IUPAC name of 3-cycloheptyl-2H-indazol-7-ol (CID 105488343) is 3-cycloheptyl-2H-indazol-7-ol.
What is the SMILES notation for 3-cycloheptyl-2H-indazol-7-ol?
The canonical SMILES for 3-cycloheptyl-2H-indazol-7-ol is Oc1cccc2c(C3CCCCCC3)[nH]nc12.
What is the InChIKey of 3-cycloheptyl-2H-indazol-7-ol?
The InChIKey is DUDJIDLTEUYJDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c17-12-9-5-8-11-13(15-16-14(11)12)10-6-3-1-2-4-7-10/h5,8-10,17H,1-4,6-7H2,(H,15,16).
What are the key properties of 3-cycloheptyl-2H-indazol-7-ol?
3-cycloheptyl-2H-indazol-7-ol has a molecular weight of 230.31 g/mol, XLogP of 3.71, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cycloheptyl-2H-indazol-7-ol is sourced from PubChem (CID 105488343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).