1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine

C13H18N2O — CID 143109237

IUPAC1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine
SMILESCOCCCCc1nc(C)n2ccccc12
InChIInChI=1S/C13H18N2O/c1-11-14-12(7-4-6-10-16-2)13-8-3-5-9-15(11)13/h3,5,8-9H,4,6-7,10H2,1-2H3
InChIKeyCEIGQRUFDBTVDA-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.61
Rot. Bonds5

About 1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine

1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine (PubChem CID 143109237) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine
PubChem CID143109237
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine
SMILESCOCCCCc1nc(C)n2ccccc12
InChIInChI=1S/C13H18N2O/c1-11-14-12(7-4-6-10-16-2)13-8-3-5-9-15(11)13/h3,5,8-9H,4,6-7,10H2,1-2H3
InChIKeyCEIGQRUFDBTVDA-UHFFFAOYSA-N
XLogP2.61
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine 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

3-methyl-1-propylimidazo[1,5-a]pyridine
CID 145078679
1-(chloromethyl)-3-methylimidazo[1,5-a]pyridine
CID 112552822
2-methoxyethyl 3-methylimidazo[1,5-a]pyridine-1-carboxylate
CID 56795161
2-(3-methylimidazo[1,5-a]pyridin-1-yl)acetic acid
CID 28797826
N-(2-methoxyethyl)-3-methylimidazo[1,5-a]pyridine-1-carboxamide
CID 110647551
3-(2-methoxyethyl)-2-methylimidazo[1,2-a]pyridine
CID 130909325
1-(4-methoxybutyl)-2-methylbenzimidazole
CID 104649828
3-bromo-1-(methoxymethyl)imidazo[1,5-a]pyridine
CID 117247026
9-(4-methoxybutyl)acridine
CID 54573696
3-pyrrolo[1,2-a]quinoxalin-4-ylpropane-1-thiol
CID 138756919
1-(4-methoxybutyl)naphthalene
CID 69278949
3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine
CID 94231471

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine?
The IUPAC name of 1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine (CID 143109237) is 1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine.
What is the SMILES notation for 1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine?
The canonical SMILES for 1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine is COCCCCc1nc(C)n2ccccc12.
What is the InChIKey of 1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine?
The InChIKey is CEIGQRUFDBTVDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-11-14-12(7-4-6-10-16-2)13-8-3-5-9-15(11)13/h3,5,8-9H,4,6-7,10H2,1-2H3.
What are the key properties of 1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine?
1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine has a molecular weight of 218.30 g/mol, XLogP of 2.61, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxybutyl)-3-methylimidazo[1,5-a]pyridine is sourced from PubChem (CID 143109237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).