ethane;6-methoxy-2-methylindazol-7-ol

C11H16N2O2 — CID 155591258

IUPACethane;6-methoxy-2-methylindazol-7-ol
SMILESCC.COc1ccc2cn(C)nc2c1O
InChIInChI=1S/C9H10N2O2.C2H6/c1-11-5-6-3-4-7(13-2)9(12)8(6)10-11;1-2/h3-5,12H,1-2H3;1-2H3
InChIKeyLGYOOWDDYMHYBC-UHFFFAOYSA-N
MW208.26 g/mol
LogP2.31
Rot. Bonds1

About ethane;6-methoxy-2-methylindazol-7-ol

ethane;6-methoxy-2-methylindazol-7-ol (PubChem CID 155591258) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is ethane;6-methoxy-2-methylindazol-7-ol.

Molecular Properties

Compound Nameethane;6-methoxy-2-methylindazol-7-ol
PubChem CID155591258
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Nameethane;6-methoxy-2-methylindazol-7-ol
SMILESCC.COc1ccc2cn(C)nc2c1O
InChIInChI=1S/C9H10N2O2.C2H6/c1-11-5-6-3-4-7(13-2)9(12)8(6)10-11;1-2/h3-5,12H,1-2H3;1-2H3
InChIKeyLGYOOWDDYMHYBC-UHFFFAOYSA-N
XLogP2.31
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethane;6-methoxy-2-methylindazol-7-ol?
The IUPAC name of ethane;6-methoxy-2-methylindazol-7-ol (CID 155591258) is ethane;6-methoxy-2-methylindazol-7-ol.
What is the SMILES notation for ethane;6-methoxy-2-methylindazol-7-ol?
The canonical SMILES for ethane;6-methoxy-2-methylindazol-7-ol is CC.COc1ccc2cn(C)nc2c1O.
What is the InChIKey of ethane;6-methoxy-2-methylindazol-7-ol?
The InChIKey is LGYOOWDDYMHYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O2.C2H6/c1-11-5-6-3-4-7(13-2)9(12)8(6)10-11;1-2/h3-5,12H,1-2H3;1-2H3.
What are the key properties of ethane;6-methoxy-2-methylindazol-7-ol?
ethane;6-methoxy-2-methylindazol-7-ol has a molecular weight of 208.26 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-methoxy-2-methylindazol-7-ol is sourced from PubChem (CID 155591258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).