N-ethyl-2-indazol-1-yl-2-phenylethanamine

C17H19N3 — CID 62448087

IUPACN-ethyl-2-indazol-1-yl-2-phenylethanamine
SMILESCCNCC(c1ccccc1)n1ncc2ccccc21
InChIInChI=1S/C17H19N3/c1-2-18-13-17(14-8-4-3-5-9-14)20-16-11-7-6-10-15(16)12-19-20/h3-12,17-18H,2,13H2,1H3
InChIKeyXXOMJEZSWNAPNH-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.24
Rot. Bonds5

About N-ethyl-2-indazol-1-yl-2-phenylethanamine

N-ethyl-2-indazol-1-yl-2-phenylethanamine (PubChem CID 62448087) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-ethyl-2-indazol-1-yl-2-phenylethanamine.

Molecular Properties

Compound NameN-ethyl-2-indazol-1-yl-2-phenylethanamine
PubChem CID62448087
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC NameN-ethyl-2-indazol-1-yl-2-phenylethanamine
SMILESCCNCC(c1ccccc1)n1ncc2ccccc21
InChIInChI=1S/C17H19N3/c1-2-18-13-17(14-8-4-3-5-9-14)20-16-11-7-6-10-15(16)12-19-20/h3-12,17-18H,2,13H2,1H3
InChIKeyXXOMJEZSWNAPNH-UHFFFAOYSA-N
XLogP3.24
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-2-indazol-1-yl-2-phenylethanamine 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 N-ethyl-2-indazol-1-yl-2-phenylethanamine?
The IUPAC name of N-ethyl-2-indazol-1-yl-2-phenylethanamine (CID 62448087) is N-ethyl-2-indazol-1-yl-2-phenylethanamine.
What is the SMILES notation for N-ethyl-2-indazol-1-yl-2-phenylethanamine?
The canonical SMILES for N-ethyl-2-indazol-1-yl-2-phenylethanamine is CCNCC(c1ccccc1)n1ncc2ccccc21.
What is the InChIKey of N-ethyl-2-indazol-1-yl-2-phenylethanamine?
The InChIKey is XXOMJEZSWNAPNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-2-18-13-17(14-8-4-3-5-9-14)20-16-11-7-6-10-15(16)12-19-20/h3-12,17-18H,2,13H2,1H3.
What are the key properties of N-ethyl-2-indazol-1-yl-2-phenylethanamine?
N-ethyl-2-indazol-1-yl-2-phenylethanamine has a molecular weight of 265.36 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-indazol-1-yl-2-phenylethanamine is sourced from PubChem (CID 62448087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).