2-(3-indazol-1-ylphenyl)ethanamine

C15H15N3 — CID 63942339

IUPAC2-(3-indazol-1-ylphenyl)ethanamine
SMILESNCCc1cccc(-n2ncc3ccccc32)c1
InChIInChI=1S/C15H15N3/c16-9-8-12-4-3-6-14(10-12)18-15-7-2-1-5-13(15)11-17-18/h1-7,10-11H,8-9,16H2
InChIKeySPZMQUOEONSCQL-UHFFFAOYSA-N
MW237.31 g/mol
LogP2.53
Rot. Bonds3

About 2-(3-indazol-1-ylphenyl)ethanamine

2-(3-indazol-1-ylphenyl)ethanamine (PubChem CID 63942339) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is 2-(3-indazol-1-ylphenyl)ethanamine.

Molecular Properties

Compound Name2-(3-indazol-1-ylphenyl)ethanamine
PubChem CID63942339
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name2-(3-indazol-1-ylphenyl)ethanamine
SMILESNCCc1cccc(-n2ncc3ccccc32)c1
InChIInChI=1S/C15H15N3/c16-9-8-12-4-3-6-14(10-12)18-15-7-2-1-5-13(15)11-17-18/h1-7,10-11H,8-9,16H2
InChIKeySPZMQUOEONSCQL-UHFFFAOYSA-N
XLogP2.53
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-indazol-1-ylphenyl)ethanamine?
The IUPAC name of 2-(3-indazol-1-ylphenyl)ethanamine (CID 63942339) is 2-(3-indazol-1-ylphenyl)ethanamine.
What is the SMILES notation for 2-(3-indazol-1-ylphenyl)ethanamine?
The canonical SMILES for 2-(3-indazol-1-ylphenyl)ethanamine is NCCc1cccc(-n2ncc3ccccc32)c1.
What is the InChIKey of 2-(3-indazol-1-ylphenyl)ethanamine?
The InChIKey is SPZMQUOEONSCQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c16-9-8-12-4-3-6-14(10-12)18-15-7-2-1-5-13(15)11-17-18/h1-7,10-11H,8-9,16H2.
What are the key properties of 2-(3-indazol-1-ylphenyl)ethanamine?
2-(3-indazol-1-ylphenyl)ethanamine has a molecular weight of 237.31 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-indazol-1-ylphenyl)ethanamine is sourced from PubChem (CID 63942339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).