(7-methyl-2-propan-2-ylindazol-3-yl)methanamine

C12H17N3 — CID 84721653

IUPAC(7-methyl-2-propan-2-ylindazol-3-yl)methanamine
SMILESCc1cccc2c(CN)n(C(C)C)nc12
InChIInChI=1S/C12H17N3/c1-8(2)15-11(7-13)10-6-4-5-9(3)12(10)14-15/h4-6,8H,7,13H2,1-3H3
InChIKeyBNJGPESWZJSALV-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.38
Rot. Bonds2

About (7-methyl-2-propan-2-ylindazol-3-yl)methanamine

(7-methyl-2-propan-2-ylindazol-3-yl)methanamine (PubChem CID 84721653) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is (7-methyl-2-propan-2-ylindazol-3-yl)methanamine.

Molecular Properties

Compound Name(7-methyl-2-propan-2-ylindazol-3-yl)methanamine
PubChem CID84721653
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC Name(7-methyl-2-propan-2-ylindazol-3-yl)methanamine
SMILESCc1cccc2c(CN)n(C(C)C)nc12
InChIInChI=1S/C12H17N3/c1-8(2)15-11(7-13)10-6-4-5-9(3)12(10)14-15/h4-6,8H,7,13H2,1-3H3
InChIKeyBNJGPESWZJSALV-UHFFFAOYSA-N
XLogP2.38
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (7-methyl-2-propan-2-ylindazol-3-yl)methanamine 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 (7-methyl-2-propan-2-ylindazol-3-yl)methanamine?
The IUPAC name of (7-methyl-2-propan-2-ylindazol-3-yl)methanamine (CID 84721653) is (7-methyl-2-propan-2-ylindazol-3-yl)methanamine.
What is the SMILES notation for (7-methyl-2-propan-2-ylindazol-3-yl)methanamine?
The canonical SMILES for (7-methyl-2-propan-2-ylindazol-3-yl)methanamine is Cc1cccc2c(CN)n(C(C)C)nc12.
What is the InChIKey of (7-methyl-2-propan-2-ylindazol-3-yl)methanamine?
The InChIKey is BNJGPESWZJSALV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-8(2)15-11(7-13)10-6-4-5-9(3)12(10)14-15/h4-6,8H,7,13H2,1-3H3.
What are the key properties of (7-methyl-2-propan-2-ylindazol-3-yl)methanamine?
(7-methyl-2-propan-2-ylindazol-3-yl)methanamine has a molecular weight of 203.29 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methyl-2-propan-2-ylindazol-3-yl)methanamine is sourced from PubChem (CID 84721653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).