2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine

C17H27N3O — CID 82055785

IUPAC2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine
SMILESCCCCCCCOc1cccn2c(CCN)c(C)nc12
InChIInChI=1S/C17H27N3O/c1-3-4-5-6-7-13-21-16-9-8-12-20-15(10-11-18)14(2)19-17(16)20/h8-9,12H,3-7,10-11,13,18H2,1-2H3
InChIKeyZRHLSZOYVXAGHQ-UHFFFAOYSA-N
MW289.42 g/mol
LogP3.49
Rot. Bonds9

About 2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine

2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine (PubChem CID 82055785) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine.

Molecular Properties

Compound Name2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine
PubChem CID82055785
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine
SMILESCCCCCCCOc1cccn2c(CCN)c(C)nc12
InChIInChI=1S/C17H27N3O/c1-3-4-5-6-7-13-21-16-9-8-12-20-15(10-11-18)14(2)19-17(16)20/h8-9,12H,3-7,10-11,13,18H2,1-2H3
InChIKeyZRHLSZOYVXAGHQ-UHFFFAOYSA-N
XLogP3.49
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-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

Related Compounds

2-[3-(2-aminoethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]oxy-N-butylacetamide
CID 82055769
4-methyl-2-[(2-methyl-8-pentoxyimidazo[1,2-a]pyridin-3-yl)methyl]-5-propyl-1,3-thiazole
CID 14676276
2-(2-phenyl-8-propoxyimidazo[1,2-a]pyridin-3-yl)ethanamine
CID 82055762
[8-[3-(2,4-dichlorophenyl)propoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]methanol
CID 131737642
2-(6-methyl-3-pentoxy-2-pyridinyl)ethanamine
CID 79168982
4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine
CID 82146556
2-[8-(2-amino-2-oxoethoxy)-2-methylimidazo[1,2-a]pyridin-3-yl]acetic acid
CID 82055736
2-(2-chloro-6-decoxyphenyl)ethanamine
CID 114321578
6-[3-(2-carboxy-2-cyanoethenyl)-2-octoxyimidazo[1,2-a]pyridin-8-yl]oxyhexanoic acid
CID 139928782
ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine
CID 91437982
1-methyl-2-pentadecoxybenzene
CID 154641785
2-tridecoxyphenol
CID 67178320

Frequently Asked Questions

What is the IUPAC name of 2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine?
The IUPAC name of 2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine (CID 82055785) is 2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine.
What is the SMILES notation for 2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine?
The canonical SMILES for 2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine is CCCCCCCOc1cccn2c(CCN)c(C)nc12.
What is the InChIKey of 2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine?
The InChIKey is ZRHLSZOYVXAGHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-3-4-5-6-7-13-21-16-9-8-12-20-15(10-11-18)14(2)19-17(16)20/h8-9,12H,3-7,10-11,13,18H2,1-2H3.
What are the key properties of 2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine?
2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine has a molecular weight of 289.42 g/mol, XLogP of 3.49, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-heptoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine is sourced from PubChem (CID 82055785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).