N-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide

C19H16N4O3 — CID 110619665

IUPACN-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide
SMILESCOc1cccc(-c2cc(C(=O)NCc3ncc4ccccn34)no2)c1
InChIInChI=1S/C19H16N4O3/c1-25-15-7-4-5-13(9-15)17-10-16(22-26-17)19(24)21-12-18-20-11-14-6-2-3-8-23(14)18/h2-11H,12H2,1H3,(H,21,24)
InChIKeyAHERCKUHDTWTPE-UHFFFAOYSA-N
MW348.36 g/mol
LogP2.93
Rot. Bonds5

About N-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide

N-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide (PubChem CID 110619665) has the molecular formula C19H16N4O3 and a molecular weight of 348.36 g/mol. Its IUPAC name is N-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide
PubChem CID110619665
Molecular FormulaC19H16N4O3
Molecular Weight348.36 g/mol
Exact Mass348.12
IUPAC NameN-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide
SMILESCOc1cccc(-c2cc(C(=O)NCc3ncc4ccccn34)no2)c1
InChIInChI=1S/C19H16N4O3/c1-25-15-7-4-5-13(9-15)17-10-16(22-26-17)19(24)21-12-18-20-11-14-6-2-3-8-23(14)18/h2-11H,12H2,1H3,(H,21,24)
InChIKeyAHERCKUHDTWTPE-UHFFFAOYSA-N
XLogP2.93
TPSA81.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.36
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide (CID 110619665) is N-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide is COc1cccc(-c2cc(C(=O)NCc3ncc4ccccn34)no2)c1.
What is the InChIKey of N-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide?
The InChIKey is AHERCKUHDTWTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O3/c1-25-15-7-4-5-13(9-15)17-10-16(22-26-17)19(24)21-12-18-20-11-14-6-2-3-8-23(14)18/h2-11H,12H2,1H3,(H,21,24).
What are the key properties of N-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide?
N-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide has a molecular weight of 348.36 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[1,5-a]pyridin-3-ylmethyl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 110619665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).