1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

C18H19N5O4 — CID 109069566

IUPAC1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESCc1cc(NC(=O)c2nc(C(=O)NCC3CCCO3)n3ccccc23)no1
InChIInChI=1S/C18H19N5O4/c1-11-9-14(22-27-11)20-17(24)15-13-6-2-3-7-23(13)16(21-15)18(25)19-10-12-5-4-8-26-12/h2-3,6-7,9,12H,4-5,8,10H2,1H3,(H,19,25)(H,20,22,24)
InChIKeyDRXYZJOKZMZIIU-UHFFFAOYSA-N
MW369.38 g/mol
LogP1.79
Rot. Bonds5

About 1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (PubChem CID 109069566) has the molecular formula C18H19N5O4 and a molecular weight of 369.38 g/mol. Its IUPAC name is 1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.

Molecular Properties

Compound Name1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
PubChem CID109069566
Molecular FormulaC18H19N5O4
Molecular Weight369.38 g/mol
Exact Mass369.14
IUPAC Name1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESCc1cc(NC(=O)c2nc(C(=O)NCC3CCCO3)n3ccccc23)no1
InChIInChI=1S/C18H19N5O4/c1-11-9-14(22-27-11)20-17(24)15-13-6-2-3-7-23(13)16(21-15)18(25)19-10-12-5-4-8-26-12/h2-3,6-7,9,12H,4-5,8,10H2,1H3,(H,19,25)(H,20,22,24)
InChIKeyDRXYZJOKZMZIIU-UHFFFAOYSA-N
XLogP1.79
TPSA110.76 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.38
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The IUPAC name of 1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (CID 109069566) is 1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.
What is the SMILES notation for 1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The canonical SMILES for 1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is Cc1cc(NC(=O)c2nc(C(=O)NCC3CCCO3)n3ccccc23)no1.
What is the InChIKey of 1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The InChIKey is DRXYZJOKZMZIIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O4/c1-11-9-14(22-27-11)20-17(24)15-13-6-2-3-7-23(13)16(21-15)18(25)19-10-12-5-4-8-26-12/h2-3,6-7,9,12H,4-5,8,10H2,1H3,(H,19,25)(H,20,22,24).
What are the key properties of 1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide has a molecular weight of 369.38 g/mol, XLogP of 1.79, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(5-methyl-1,2-oxazol-3-yl)-3-N-(oxolan-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is sourced from PubChem (CID 109069566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).