N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine

C18H21N3 — CID 102626379

IUPACN-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine
SMILESCCCNCc1ccc(-c2cccc3nccn23)c(C)c1
InChIInChI=1S/C18H21N3/c1-3-9-19-13-15-7-8-16(14(2)12-15)17-5-4-6-18-20-10-11-21(17)18/h4-8,10-12,19H,3,9,13H2,1-2H3
InChIKeyJNATVVGWSPEESY-UHFFFAOYSA-N
MW279.39 g/mol
LogP3.81
Rot. Bonds5

About N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine

N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine (PubChem CID 102626379) has the molecular formula C18H21N3 and a molecular weight of 279.39 g/mol. Its IUPAC name is N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine
PubChem CID102626379
Molecular FormulaC18H21N3
Molecular Weight279.39 g/mol
Exact Mass279.17
IUPAC NameN-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine
SMILESCCCNCc1ccc(-c2cccc3nccn23)c(C)c1
InChIInChI=1S/C18H21N3/c1-3-9-19-13-15-7-8-16(14(2)12-15)17-5-4-6-18-20-10-11-21(17)18/h4-8,10-12,19H,3,9,13H2,1-2H3
InChIKeyJNATVVGWSPEESY-UHFFFAOYSA-N
XLogP3.81
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)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

Related Compounds

N-[(3-fluoro-4-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine
CID 102626421
N-[(3-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-1-amine
CID 102626428
6-imidazo[1,2-a]pyridin-5-yl-2-methyl-N-propylpyrimidin-4-amine
CID 102627293
N-[[3-methyl-4-(3-propyltriazol-4-yl)phenyl]methyl]propan-1-amine
CID 114689849
N-[[3-methyl-4-[(1-methylimidazol-2-yl)methyl]phenyl]methyl]propan-1-amine
CID 79737937
N-[[4-(2-ethylimidazol-1-yl)-3-methylphenyl]methyl]propan-1-amine
CID 62124555
6-imidazo[1,2-a]pyridin-5-yl-N-propylpyridin-2-amine
CID 102627302
4-imidazo[1,2-a]pyridin-5-yl-N-propylpyrimidin-2-amine
CID 102627307
N-[(2-imidazo[1,2-a]pyridin-5-yl-4-methylphenyl)methyl]propan-2-amine
CID 102626382
N-[[4-methyl-3-(2-propylimidazol-1-yl)phenyl]methyl]propan-1-amine
CID 105406336
N-[[4-(1-benzothiophen-7-yl)-3-methylphenyl]methyl]propan-1-amine
CID 81128623
N-[(4-imidazo[1,2-a]pyridin-5-ylphenyl)methyl]propan-2-amine
CID 102626371

Frequently Asked Questions

What is the IUPAC name of N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine?
The IUPAC name of N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine (CID 102626379) is N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine.
What is the SMILES notation for N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine?
The canonical SMILES for N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine is CCCNCc1ccc(-c2cccc3nccn23)c(C)c1.
What is the InChIKey of N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine?
The InChIKey is JNATVVGWSPEESY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3/c1-3-9-19-13-15-7-8-16(14(2)12-15)17-5-4-6-18-20-10-11-21(17)18/h4-8,10-12,19H,3,9,13H2,1-2H3.
What are the key properties of N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine?
N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine has a molecular weight of 279.39 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-imidazo[1,2-a]pyridin-5-yl-3-methylphenyl)methyl]propan-1-amine is sourced from PubChem (CID 102626379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).