N-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide

C18H24N4O2 — CID 109067949

IUPACN-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESCCCCN(C)C(=O)c1nc(C(=O)N2CCCC2)c2ccccn12
InChIInChI=1S/C18H24N4O2/c1-3-4-10-20(2)18(24)16-19-15(14-9-5-6-13-22(14)16)17(23)21-11-7-8-12-21/h5-6,9,13H,3-4,7-8,10-12H2,1-2H3
InChIKeyVXMFHPIKGRXOOP-UHFFFAOYSA-N
MW328.42 g/mol
LogP2.44
Rot. Bonds5

About N-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide

N-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 109067949) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is N-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
PubChem CID109067949
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC NameN-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESCCCCN(C)C(=O)c1nc(C(=O)N2CCCC2)c2ccccn12
InChIInChI=1S/C18H24N4O2/c1-3-4-10-20(2)18(24)16-19-15(14-9-5-6-13-22(14)16)17(23)21-11-7-8-12-21/h5-6,9,13H,3-4,7-8,10-12H2,1-2H3
InChIKeyVXMFHPIKGRXOOP-UHFFFAOYSA-N
XLogP2.44
TPSA57.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109068377
1-N-benzyl-3-N-butyl-1-N,3-N-dimethylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070445
3-N-butyl-1-N-cycloheptyl-3-N-methylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071214
1-(4-acetylpiperazine-1-carbonyl)-N,N-dipropylimidazo[1,5-a]pyridine-3-carboxamide
CID 109070097
1-N,3-N-dibutyl-1-N-methylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067304
1-[4-[3-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carbonyl]piperazin-1-yl]ethanone
CID 109068040
3-N-butyl-1-N-(4-ethylphenyl)-3-N-methylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071536
3-N-butyl-1-N-(2-fluorophenyl)-3-N-methylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071542
N-benzyl-N-propan-2-yl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109067946
3-N-butyl-3-N-methyl-1-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071524
3-N-butyl-3-N-methyl-1-N-(pyridin-3-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070647
[3-(4-methylpiperazine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]-piperidin-1-ylmethanone
CID 109068367

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (CID 109067949) is N-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is CCCCN(C)C(=O)c1nc(C(=O)N2CCCC2)c2ccccn12.
What is the InChIKey of N-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is VXMFHPIKGRXOOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-3-4-10-20(2)18(24)16-19-15(14-9-5-6-13-22(14)16)17(23)21-11-7-8-12-21/h5-6,9,13H,3-4,7-8,10-12H2,1-2H3.
What are the key properties of N-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
N-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 2.44, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-methyl-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 109067949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).