N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine

C17H19N3 — CID 102626428

IUPACN-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine
SMILESCCCNCc1cccc(-c2cccc3nccn23)c1
InChIInChI=1S/C17H19N3/c1-2-9-18-13-14-5-3-6-15(12-14)16-7-4-8-17-19-10-11-20(16)17/h3-8,10-12,18H,2,9,13H2,1H3
InChIKeyGPOPLOGFALNFSZ-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.50
Rot. Bonds5

About N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine

N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine (PubChem CID 102626428) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine
PubChem CID102626428
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC NameN-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine
SMILESCCCNCc1cccc(-c2cccc3nccn23)c1
InChIInChI=1S/C17H19N3/c1-2-9-18-13-14-5-3-6-15(12-14)16-7-4-8-17-19-10-11-20(16)17/h3-8,10-12,18H,2,9,13H2,1H3
InChIKeyGPOPLOGFALNFSZ-UHFFFAOYSA-N
XLogP3.50
TPSA29.33 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 ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine 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-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine?
The IUPAC name of N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine (CID 102626428) is N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine.
What is the SMILES notation for N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine?
The canonical SMILES for N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine is CCCNCc1cccc(-c2cccc3nccn23)c1.
What is the InChIKey of N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine?
The InChIKey is GPOPLOGFALNFSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-2-9-18-13-14-5-3-6-15(12-14)16-7-4-8-17-19-10-11-20(16)17/h3-8,10-12,18H,2,9,13H2,1H3.
What are the key properties of N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine?
N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine has a molecular weight of 265.36 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine is sourced from PubChem (CID 102626428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).