N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide

C17H20N4O2 — CID 110630869

IUPACN-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide
SMILESCc1noc(C(C)C)c1C(=O)NCCc1ncc2ccccn12
InChIInChI=1S/C17H20N4O2/c1-11(2)16-15(12(3)20-23-16)17(22)18-8-7-14-19-10-13-6-4-5-9-21(13)14/h4-6,9-11H,7-8H2,1-3H3,(H,18,22)
InChIKeyUJWHMDOKZVZCOY-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.73
Rot. Bonds5

About N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide

N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide (PubChem CID 110630869) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide
PubChem CID110630869
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC NameN-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide
SMILESCc1noc(C(C)C)c1C(=O)NCCc1ncc2ccccn12
InChIInChI=1S/C17H20N4O2/c1-11(2)16-15(12(3)20-23-16)17(22)18-8-7-14-19-10-13-6-4-5-9-21(13)14/h4-6,9-11H,7-8H2,1-3H3,(H,18,22)
InChIKeyUJWHMDOKZVZCOY-UHFFFAOYSA-N
XLogP2.73
TPSA72.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide?
The IUPAC name of N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide (CID 110630869) is N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide is Cc1noc(C(C)C)c1C(=O)NCCc1ncc2ccccn12.
What is the InChIKey of N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide?
The InChIKey is UJWHMDOKZVZCOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2/c1-11(2)16-15(12(3)20-23-16)17(22)18-8-7-14-19-10-13-6-4-5-9-21(13)14/h4-6,9-11H,7-8H2,1-3H3,(H,18,22).
What are the key properties of N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide?
N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 110630869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).