2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide

C16H13N3O2 — CID 53014051

IUPAC2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1cc(-c2cccnc2)no1
InChIInChI=1S/C16H13N3O2/c1-11-5-2-3-7-13(11)16(20)18-15-9-14(19-21-15)12-6-4-8-17-10-12/h2-10H,1H3,(H,18,20)
InChIKeyXFUGVKXGLJHMDY-UHFFFAOYSA-N
MW279.30 g/mol
LogP3.30
Rot. Bonds3

About 2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide

2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide (PubChem CID 53014051) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is 2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide.

Molecular Properties

Compound Name2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide
PubChem CID53014051
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC Name2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1cc(-c2cccnc2)no1
InChIInChI=1S/C16H13N3O2/c1-11-5-2-3-7-13(11)16(20)18-15-9-14(19-21-15)12-6-4-8-17-10-12/h2-10H,1H3,(H,18,20)
InChIKeyXFUGVKXGLJHMDY-UHFFFAOYSA-N
XLogP3.30
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide?
The IUPAC name of 2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide (CID 53014051) is 2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide.
What is the SMILES notation for 2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide?
The canonical SMILES for 2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide is Cc1ccccc1C(=O)Nc1cc(-c2cccnc2)no1.
What is the InChIKey of 2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide?
The InChIKey is XFUGVKXGLJHMDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c1-11-5-2-3-7-13(11)16(20)18-15-9-14(19-21-15)12-6-4-8-17-10-12/h2-10H,1H3,(H,18,20).
What are the key properties of 2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide?
2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide has a molecular weight of 279.30 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide is sourced from PubChem (CID 53014051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).