N-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide

C17H25N3O2 — CID 110610181

IUPACN-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCOCCCCNC(=O)c1nc(CC(C)C)n2ccccc12
InChIInChI=1S/C17H25N3O2/c1-13(2)12-15-19-16(14-8-4-6-10-20(14)15)17(21)18-9-5-7-11-22-3/h4,6,8,10,13H,5,7,9,11-12H2,1-3H3,(H,18,21)
InChIKeyQZWZCNZNZFBAFS-UHFFFAOYSA-N
MW303.41 g/mol
LogP2.69
Rot. Bonds8

About N-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide

N-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 110610181) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is N-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID110610181
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC NameN-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCOCCCCNC(=O)c1nc(CC(C)C)n2ccccc12
InChIInChI=1S/C17H25N3O2/c1-13(2)12-15-19-16(14-8-4-6-10-20(14)15)17(21)18-9-5-7-11-22-3/h4,6,8,10,13H,5,7,9,11-12H2,1-3H3,(H,18,21)
InChIKeyQZWZCNZNZFBAFS-UHFFFAOYSA-N
XLogP2.69
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-acetamidoethyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 110674791
N-(4-acetamidophenyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 110423911
N-(2-methoxyethyl)-3-methylimidazo[1,5-a]pyridine-1-carboxamide
CID 110647551
3-ethyl-N-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 110674606
methyl 3-(2-hydroxypropyl)imidazo[1,5-a]pyridine-1-carboxylate
CID 117252766
1-N-(3-methoxypropyl)-3-N-prop-2-enylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066968
3-N-(2-methylpropyl)-1-N-pentylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067562
N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 110625372
3-ethyl-N-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
CID 110674602
3-N-benzyl-1-N-(3-methoxypropyl)-3-N-methylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109069112
3-N-[(2-fluorophenyl)methyl]-1-N-(3-methoxypropyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109069113
1-N-(2-methoxyethyl)-3-N-(3-phenylpropyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068900

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide (CID 110610181) is N-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide is COCCCCNC(=O)c1nc(CC(C)C)n2ccccc12.
What is the InChIKey of N-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is QZWZCNZNZFBAFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c1-13(2)12-15-19-16(14-8-4-6-10-20(14)15)17(21)18-9-5-7-11-22-3/h4,6,8,10,13H,5,7,9,11-12H2,1-3H3,(H,18,21).
What are the key properties of N-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide?
N-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 303.41 g/mol, XLogP of 2.69, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxybutyl)-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 110610181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).