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

C18H24N4O2 — CID 109068496

IUPACN-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)(C)NC(=O)c1nc(C(=O)N2CCCCC2)n2ccccc12
InChIInChI=1S/C18H24N4O2/c1-18(2,3)20-16(23)14-13-9-5-8-12-22(13)15(19-14)17(24)21-10-6-4-7-11-21/h5,8-9,12H,4,6-7,10-11H2,1-3H3,(H,20,23)
InChIKeyILMZFYIWJBSDMO-UHFFFAOYSA-N
MW328.42 g/mol
LogP2.49
Rot. Bonds2

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

N-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109068496) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is N-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID109068496
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC NameN-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)(C)NC(=O)c1nc(C(=O)N2CCCCC2)n2ccccc12
InChIInChI=1S/C18H24N4O2/c1-18(2,3)20-16(23)14-13-9-5-8-12-22(13)15(19-14)17(24)21-10-6-4-7-11-21/h5,8-9,12H,4,6-7,10-11H2,1-3H3,(H,20,23)
InChIKeyILMZFYIWJBSDMO-UHFFFAOYSA-N
XLogP2.49
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (CID 109068496) is N-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is CC(C)(C)NC(=O)c1nc(C(=O)N2CCCCC2)n2ccccc12.
What is the InChIKey of N-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is ILMZFYIWJBSDMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-18(2,3)20-16(23)14-13-9-5-8-12-22(13)15(19-14)17(24)21-10-6-4-7-11-21/h5,8-9,12H,4,6-7,10-11H2,1-3H3,(H,20,23).
What are the key properties of N-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
N-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109068496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).