[2-(2-methylindazol-4-yl)cyclopropyl]methanamine

C12H15N3 — CID 59334507

IUPAC[2-(2-methylindazol-4-yl)cyclopropyl]methanamine
SMILESCn1cc2c(C3CC3CN)cccc2n1
InChIInChI=1S/C12H15N3/c1-15-7-11-9(10-5-8(10)6-13)3-2-4-12(11)14-15/h2-4,7-8,10H,5-6,13H2,1H3
InChIKeySTGRIOCNIQBCCG-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.64
Rot. Bonds2

About [2-(2-methylindazol-4-yl)cyclopropyl]methanamine

[2-(2-methylindazol-4-yl)cyclopropyl]methanamine (PubChem CID 59334507) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is [2-(2-methylindazol-4-yl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[2-(2-methylindazol-4-yl)cyclopropyl]methanamine
PubChem CID59334507
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name[2-(2-methylindazol-4-yl)cyclopropyl]methanamine
SMILESCn1cc2c(C3CC3CN)cccc2n1
InChIInChI=1S/C12H15N3/c1-15-7-11-9(10-5-8(10)6-13)3-2-4-12(11)14-15/h2-4,7-8,10H,5-6,13H2,1H3
InChIKeySTGRIOCNIQBCCG-UHFFFAOYSA-N
XLogP1.64
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(2-methylindazol-4-yl)cyclopropyl]methanamine?
The IUPAC name of [2-(2-methylindazol-4-yl)cyclopropyl]methanamine (CID 59334507) is [2-(2-methylindazol-4-yl)cyclopropyl]methanamine.
What is the SMILES notation for [2-(2-methylindazol-4-yl)cyclopropyl]methanamine?
The canonical SMILES for [2-(2-methylindazol-4-yl)cyclopropyl]methanamine is Cn1cc2c(C3CC3CN)cccc2n1.
What is the InChIKey of [2-(2-methylindazol-4-yl)cyclopropyl]methanamine?
The InChIKey is STGRIOCNIQBCCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-15-7-11-9(10-5-8(10)6-13)3-2-4-12(11)14-15/h2-4,7-8,10H,5-6,13H2,1H3.
What are the key properties of [2-(2-methylindazol-4-yl)cyclopropyl]methanamine?
[2-(2-methylindazol-4-yl)cyclopropyl]methanamine has a molecular weight of 201.27 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methylindazol-4-yl)cyclopropyl]methanamine is sourced from PubChem (CID 59334507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).