2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide

C19H16N6O2 — CID 47037766

IUPAC2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide
SMILESCc1oc(-c2ccccc2)nc1CC(=O)Nc1n[nH]c(-c2ccccn2)n1
InChIInChI=1S/C19H16N6O2/c1-12-15(21-18(27-12)13-7-3-2-4-8-13)11-16(26)22-19-23-17(24-25-19)14-9-5-6-10-20-14/h2-10H,11H2,1H3,(H2,22,23,24,25,26)
InChIKeyUZQZQBVCALCPTQ-UHFFFAOYSA-N
MW360.38 g/mol
LogP3.01
Rot. Bonds5

About 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide

2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide (PubChem CID 47037766) has the molecular formula C19H16N6O2 and a molecular weight of 360.38 g/mol. Its IUPAC name is 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide
PubChem CID47037766
Molecular FormulaC19H16N6O2
Molecular Weight360.38 g/mol
Exact Mass360.13
IUPAC Name2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide
SMILESCc1oc(-c2ccccc2)nc1CC(=O)Nc1n[nH]c(-c2ccccn2)n1
InChIInChI=1S/C19H16N6O2/c1-12-15(21-18(27-12)13-7-3-2-4-8-13)11-16(26)22-19-23-17(24-25-19)14-9-5-6-10-20-14/h2-10H,11H2,1H3,(H2,22,23,24,25,26)
InChIKeyUZQZQBVCALCPTQ-UHFFFAOYSA-N
XLogP3.01
TPSA109.59 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.38
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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CID 86992038
N-(2-chloro-4,6-dimethylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide?
The IUPAC name of 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide (CID 47037766) is 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide.
What is the SMILES notation for 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide?
The canonical SMILES for 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide is Cc1oc(-c2ccccc2)nc1CC(=O)Nc1n[nH]c(-c2ccccn2)n1.
What is the InChIKey of 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide?
The InChIKey is UZQZQBVCALCPTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N6O2/c1-12-15(21-18(27-12)13-7-3-2-4-8-13)11-16(26)22-19-23-17(24-25-19)14-9-5-6-10-20-14/h2-10H,11H2,1H3,(H2,22,23,24,25,26).
What are the key properties of 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide?
2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide has a molecular weight of 360.38 g/mol, XLogP of 3.01, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide is sourced from PubChem (CID 47037766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).