5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide

C17H15N3O2 — CID 1122423

IUPAC5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide
SMILESCc1cccc(NC(=O)c2c(-c3ccccc3)noc2C)n1
InChIInChI=1S/C17H15N3O2/c1-11-7-6-10-14(18-11)19-17(21)15-12(2)22-20-16(15)13-8-4-3-5-9-13/h3-10H,1-2H3,(H,18,19,21)
InChIKeyYZCRMFUXTZDHKS-UHFFFAOYSA-N
MW293.33 g/mol
LogP3.61
Rot. Bonds3

About 5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide

5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide (PubChem CID 1122423) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is 5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide
PubChem CID1122423
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide
SMILESCc1cccc(NC(=O)c2c(-c3ccccc3)noc2C)n1
InChIInChI=1S/C17H15N3O2/c1-11-7-6-10-14(18-11)19-17(21)15-12(2)22-20-16(15)13-8-4-3-5-9-13/h3-10H,1-2H3,(H,18,19,21)
InChIKeyYZCRMFUXTZDHKS-UHFFFAOYSA-N
XLogP3.61
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide?
The IUPAC name of 5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide (CID 1122423) is 5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide is Cc1cccc(NC(=O)c2c(-c3ccccc3)noc2C)n1.
What is the InChIKey of 5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide?
The InChIKey is YZCRMFUXTZDHKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-11-7-6-10-14(18-11)19-17(21)15-12(2)22-20-16(15)13-8-4-3-5-9-13/h3-10H,1-2H3,(H,18,19,21).
What are the key properties of 5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide?
5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide has a molecular weight of 293.33 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(6-methyl-2-pyridinyl)-3-phenyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 1122423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).