ethane;2,5,7-trimethylindazol-6-ol

C12H18N2O — CID 162433004

IUPACethane;2,5,7-trimethylindazol-6-ol
SMILESCC.Cc1cc2cn(C)nc2c(C)c1O
InChIInChI=1S/C10H12N2O.C2H6/c1-6-4-8-5-12(3)11-9(8)7(2)10(6)13;1-2/h4-5,13H,1-3H3;1-2H3
InChIKeyFMALSAHNMFKBSH-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.92
Rot. Bonds

About ethane;2,5,7-trimethylindazol-6-ol

ethane;2,5,7-trimethylindazol-6-ol (PubChem CID 162433004) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is ethane;2,5,7-trimethylindazol-6-ol.

Molecular Properties

Compound Nameethane;2,5,7-trimethylindazol-6-ol
PubChem CID162433004
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Nameethane;2,5,7-trimethylindazol-6-ol
SMILESCC.Cc1cc2cn(C)nc2c(C)c1O
InChIInChI=1S/C10H12N2O.C2H6/c1-6-4-8-5-12(3)11-9(8)7(2)10(6)13;1-2/h4-5,13H,1-3H3;1-2H3
InChIKeyFMALSAHNMFKBSH-UHFFFAOYSA-N
XLogP2.92
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethane;2,5,7-trimethylindazol-6-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethane;2,5,7-trimethylindazol-6-ol?
The IUPAC name of ethane;2,5,7-trimethylindazol-6-ol (CID 162433004) is ethane;2,5,7-trimethylindazol-6-ol.
What is the SMILES notation for ethane;2,5,7-trimethylindazol-6-ol?
The canonical SMILES for ethane;2,5,7-trimethylindazol-6-ol is CC.Cc1cc2cn(C)nc2c(C)c1O.
What is the InChIKey of ethane;2,5,7-trimethylindazol-6-ol?
The InChIKey is FMALSAHNMFKBSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O.C2H6/c1-6-4-8-5-12(3)11-9(8)7(2)10(6)13;1-2/h4-5,13H,1-3H3;1-2H3.
What are the key properties of ethane;2,5,7-trimethylindazol-6-ol?
ethane;2,5,7-trimethylindazol-6-ol has a molecular weight of 206.29 g/mol, XLogP of 2.92, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2,5,7-trimethylindazol-6-ol is sourced from PubChem (CID 162433004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).