2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide

C16H14N2O2 — CID 2824073

IUPAC2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide
SMILESCc1nc2ccc(NC(=O)c3ccccc3C)cc2o1
InChIInChI=1S/C16H14N2O2/c1-10-5-3-4-6-13(10)16(19)18-12-7-8-14-15(9-12)20-11(2)17-14/h3-9H,1-2H3,(H,18,19)
InChIKeyBWFHREPFOXMLTH-UHFFFAOYSA-N
MW266.30 g/mol
LogP3.70
Rot. Bonds2

About 2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide

2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide (PubChem CID 2824073) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide.

Molecular Properties

Compound Name2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide
PubChem CID2824073
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide
SMILESCc1nc2ccc(NC(=O)c3ccccc3C)cc2o1
InChIInChI=1S/C16H14N2O2/c1-10-5-3-4-6-13(10)16(19)18-12-7-8-14-15(9-12)20-11(2)17-14/h3-9H,1-2H3,(H,18,19)
InChIKeyBWFHREPFOXMLTH-UHFFFAOYSA-N
XLogP3.70
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide?
The IUPAC name of 2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide (CID 2824073) is 2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide.
What is the SMILES notation for 2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide?
The canonical SMILES for 2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide is Cc1nc2ccc(NC(=O)c3ccccc3C)cc2o1.
What is the InChIKey of 2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide?
The InChIKey is BWFHREPFOXMLTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-10-5-3-4-6-13(10)16(19)18-12-7-8-14-15(9-12)20-11(2)17-14/h3-9H,1-2H3,(H,18,19).
What are the key properties of 2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide?
2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide has a molecular weight of 266.30 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide is sourced from PubChem (CID 2824073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).