1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine

C15H15N3 — CID 114702749

IUPAC1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine
SMILESCC(N)c1cncn1-c1cccc2ccccc12
InChIInChI=1S/C15H15N3/c1-11(16)15-9-17-10-18(15)14-8-4-6-12-5-2-3-7-13(12)14/h2-11H,16H2,1H3
InChIKeyBRNGUONSHJTJEZ-UHFFFAOYSA-N
MW237.31 g/mol
LogP3.05
Rot. Bonds2

About 1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine

1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine (PubChem CID 114702749) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is 1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine.

Molecular Properties

Compound Name1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine
PubChem CID114702749
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine
SMILESCC(N)c1cncn1-c1cccc2ccccc12
InChIInChI=1S/C15H15N3/c1-11(16)15-9-17-10-18(15)14-8-4-6-12-5-2-3-7-13(12)14/h2-11H,16H2,1H3
InChIKeyBRNGUONSHJTJEZ-UHFFFAOYSA-N
XLogP3.05
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine 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 1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine?
The IUPAC name of 1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine (CID 114702749) is 1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine.
What is the SMILES notation for 1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine?
The canonical SMILES for 1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine is CC(N)c1cncn1-c1cccc2ccccc12.
What is the InChIKey of 1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine?
The InChIKey is BRNGUONSHJTJEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-11(16)15-9-17-10-18(15)14-8-4-6-12-5-2-3-7-13(12)14/h2-11H,16H2,1H3.
What are the key properties of 1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine?
1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine has a molecular weight of 237.31 g/mol, XLogP of 3.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-naphthalen-1-ylimidazol-4-yl)ethanamine is sourced from PubChem (CID 114702749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).