N-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide

C20H28N4O2 — CID 109071303

IUPACN-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESCC(C)CCNC(=O)c1nc(C(=O)N2CCCC(C)C2)c2ccccn12
InChIInChI=1S/C20H28N4O2/c1-14(2)9-10-21-19(25)18-22-17(16-8-4-5-12-24(16)18)20(26)23-11-6-7-15(3)13-23/h4-5,8,12,14-15H,6-7,9-11,13H2,1-3H3,(H,21,25)
InChIKeyDUHQXAJZACOCAR-UHFFFAOYSA-N
MW356.47 g/mol
LogP2.98
Rot. Bonds5

About N-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide

N-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 109071303) has the molecular formula C20H28N4O2 and a molecular weight of 356.47 g/mol. Its IUPAC name is N-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
PubChem CID109071303
Molecular FormulaC20H28N4O2
Molecular Weight356.47 g/mol
Exact Mass356.22
IUPAC NameN-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESCC(C)CCNC(=O)c1nc(C(=O)N2CCCC(C)C2)c2ccccn12
InChIInChI=1S/C20H28N4O2/c1-14(2)9-10-21-19(25)18-22-17(16-8-4-5-12-24(16)18)20(26)23-11-6-7-15(3)13-23/h4-5,8,12,14-15H,6-7,9-11,13H2,1-3H3,(H,21,25)
InChIKeyDUHQXAJZACOCAR-UHFFFAOYSA-N
XLogP2.98
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109070794
1-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109070429
3-N-cyclohexyl-1-N-(3-methylbutyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068652
1-N-butan-2-yl-3-N-(3-methylbutyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067690
N-(3-methylbutyl)-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109069396
[3-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]-morpholin-4-ylmethanone
CID 109069309
3-(3-methylpiperidine-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-1-carboxamide
CID 109066867
N-butan-2-yl-1-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109067770
3-N-(3-methylbutyl)-1-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109069475
1-(piperidine-1-carbonyl)-N-propan-2-ylimidazo[1,5-a]pyridine-3-carboxamide
CID 109066328
[3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]-(3-methylpiperidin-1-yl)methanone
CID 109071584
3-N-(3-methylbutyl)-1-N,1-N-dipropylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071304

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (CID 109071303) is N-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is CC(C)CCNC(=O)c1nc(C(=O)N2CCCC(C)C2)c2ccccn12.
What is the InChIKey of N-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is DUHQXAJZACOCAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O2/c1-14(2)9-10-21-19(25)18-22-17(16-8-4-5-12-24(16)18)20(26)23-11-6-7-15(3)13-23/h4-5,8,12,14-15H,6-7,9-11,13H2,1-3H3,(H,21,25).
What are the key properties of N-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
N-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 356.47 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutyl)-1-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 109071303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).