2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide

C22H18N2O2 — CID 698044

IUPAC2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide
SMILESCc1ccc2oc(-c3ccc(NC(=O)c4ccccc4C)cc3)nc2c1
InChIInChI=1S/C22H18N2O2/c1-14-7-12-20-19(13-14)24-22(26-20)16-8-10-17(11-9-16)23-21(25)18-6-4-3-5-15(18)2/h3-13H,1-2H3,(H,23,25)
InChIKeyWEUGKKAMJYRJHI-UHFFFAOYSA-N
MW342.40 g/mol
LogP5.36
Rot. Bonds3

About 2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide

2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide (PubChem CID 698044) has the molecular formula C22H18N2O2 and a molecular weight of 342.40 g/mol. Its IUPAC name is 2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide
PubChem CID698044
Molecular FormulaC22H18N2O2
Molecular Weight342.40 g/mol
Exact Mass342.14
IUPAC Name2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide
SMILESCc1ccc2oc(-c3ccc(NC(=O)c4ccccc4C)cc3)nc2c1
InChIInChI=1S/C22H18N2O2/c1-14-7-12-20-19(13-14)24-22(26-20)16-8-10-17(11-9-16)23-21(25)18-6-4-3-5-15(18)2/h3-13H,1-2H3,(H,23,25)
InChIKeyWEUGKKAMJYRJHI-UHFFFAOYSA-N
XLogP5.36
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.40
LogP ≤ 55.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-N-[4-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]benzamide
CID 5229080
N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide
CID 801337
2-methyl-N-(2-pyridin-4-yl-1,3-benzoxazol-5-yl)benzamide
CID 699256
N-[2-(3,5-dimethylphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide
CID 17101713
N-[[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-methylbenzamide
CID 1048259
N-[4-(6-methyl-1,3-benzoxazol-2-yl)phenyl]naphthalene-1-carboxamide
CID 3100050
N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]pyridine-3-carboxamide
CID 645017
N-[2-(5-bromo-3-pyridinyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide
CID 1397326
3-methyl-N-[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]benzamide
CID 2833240
N-[[4-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-methylbenzamide
CID 1048278
N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-2-methoxybenzamide
CID 1049579
2-chloro-N-[2-chloro-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide
CID 23961409

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide?
The IUPAC name of 2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide (CID 698044) is 2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide.
What is the SMILES notation for 2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide?
The canonical SMILES for 2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide is Cc1ccc2oc(-c3ccc(NC(=O)c4ccccc4C)cc3)nc2c1.
What is the InChIKey of 2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide?
The InChIKey is WEUGKKAMJYRJHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O2/c1-14-7-12-20-19(13-14)24-22(26-20)16-8-10-17(11-9-16)23-21(25)18-6-4-3-5-15(18)2/h3-13H,1-2H3,(H,23,25).
What are the key properties of 2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide?
2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide has a molecular weight of 342.40 g/mol, XLogP of 5.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]benzamide is sourced from PubChem (CID 698044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).