(6-methoxy-2,3-dimethylindazol-5-yl)methanamine

C11H15N3O — CID 117110401

IUPAC(6-methoxy-2,3-dimethylindazol-5-yl)methanamine
SMILESCOc1cc2nn(C)c(C)c2cc1CN
InChIInChI=1S/C11H15N3O/c1-7-9-4-8(6-12)11(15-3)5-10(9)13-14(7)2/h4-5H,6,12H2,1-3H3
InChIKeyIYZQGTGXTVIOGL-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.35
Rot. Bonds2

About (6-methoxy-2,3-dimethylindazol-5-yl)methanamine

(6-methoxy-2,3-dimethylindazol-5-yl)methanamine (PubChem CID 117110401) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is (6-methoxy-2,3-dimethylindazol-5-yl)methanamine.

Molecular Properties

Compound Name(6-methoxy-2,3-dimethylindazol-5-yl)methanamine
PubChem CID117110401
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name(6-methoxy-2,3-dimethylindazol-5-yl)methanamine
SMILESCOc1cc2nn(C)c(C)c2cc1CN
InChIInChI=1S/C11H15N3O/c1-7-9-4-8(6-12)11(15-3)5-10(9)13-14(7)2/h4-5H,6,12H2,1-3H3
InChIKeyIYZQGTGXTVIOGL-UHFFFAOYSA-N
XLogP1.35
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-methoxy-2,3-dimethylindazol-5-yl)methanamine?
The IUPAC name of (6-methoxy-2,3-dimethylindazol-5-yl)methanamine (CID 117110401) is (6-methoxy-2,3-dimethylindazol-5-yl)methanamine.
What is the SMILES notation for (6-methoxy-2,3-dimethylindazol-5-yl)methanamine?
The canonical SMILES for (6-methoxy-2,3-dimethylindazol-5-yl)methanamine is COc1cc2nn(C)c(C)c2cc1CN.
What is the InChIKey of (6-methoxy-2,3-dimethylindazol-5-yl)methanamine?
The InChIKey is IYZQGTGXTVIOGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-7-9-4-8(6-12)11(15-3)5-10(9)13-14(7)2/h4-5H,6,12H2,1-3H3.
What are the key properties of (6-methoxy-2,3-dimethylindazol-5-yl)methanamine?
(6-methoxy-2,3-dimethylindazol-5-yl)methanamine has a molecular weight of 205.26 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxy-2,3-dimethylindazol-5-yl)methanamine is sourced from PubChem (CID 117110401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).