N-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide

C19H15N3O3 — CID 110356766

IUPACN-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
SMILESCc1nc2cccc(NC(=O)Cc3cc(-c4ccccc4)on3)c2o1
InChIInChI=1S/C19H15N3O3/c1-12-20-15-8-5-9-16(19(15)24-12)21-18(23)11-14-10-17(25-22-14)13-6-3-2-4-7-13/h2-10H,11H2,1H3,(H,21,23)
InChIKeyHGIMKCNJKQFLIJ-UHFFFAOYSA-N
MW333.35 g/mol
LogP3.97
Rot. Bonds4

About N-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide

N-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide (PubChem CID 110356766) has the molecular formula C19H15N3O3 and a molecular weight of 333.35 g/mol. Its IUPAC name is N-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
PubChem CID110356766
Molecular FormulaC19H15N3O3
Molecular Weight333.35 g/mol
Exact Mass333.11
IUPAC NameN-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
SMILESCc1nc2cccc(NC(=O)Cc3cc(-c4ccccc4)on3)c2o1
InChIInChI=1S/C19H15N3O3/c1-12-20-15-8-5-9-16(19(15)24-12)21-18(23)11-14-10-17(25-22-14)13-6-3-2-4-7-13/h2-10H,11H2,1H3,(H,21,23)
InChIKeyHGIMKCNJKQFLIJ-UHFFFAOYSA-N
XLogP3.97
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.35
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[5-(4-methylphenyl)-1,2-oxazol-3-yl]-N-(2-methylquinolin-4-yl)acetamide
CID 16878536
N-(2-fluorophenyl)-2-[5-(4-methylphenyl)-1,2-oxazol-3-yl]acetamide
CID 16878473
N-(4-hydroxyphenyl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
CID 155556405
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-methyl-1,3-benzoxazol-7-yl)acetamide
CID 110609698
2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(2-phenylphenyl)acetamide
CID 16878671
N-(4-methoxyphenyl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
CID 16878325
N-(2-methyl-1,3-benzoxazol-7-yl)-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)propanamide
CID 110417882
N-(2-ethylphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide
CID 16878811
N-(2-methyl-1,3-benzoxazol-7-yl)-3-phenoxypropanamide
CID 110358500
N-(3-chloro-2-methylphenyl)-2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]acetamide
CID 16879203
N-(3-chloro-2-methylphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide
CID 16878861
N-(2-methyl-1,3-benzoxazol-7-yl)-4-(2-methylphenyl)-4-oxobutanamide
CID 110417896

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of N-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide (CID 110356766) is N-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for N-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for N-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide is Cc1nc2cccc(NC(=O)Cc3cc(-c4ccccc4)on3)c2o1.
What is the InChIKey of N-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is HGIMKCNJKQFLIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O3/c1-12-20-15-8-5-9-16(19(15)24-12)21-18(23)11-14-10-17(25-22-14)13-6-3-2-4-7-13/h2-10H,11H2,1H3,(H,21,23).
What are the key properties of N-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide?
N-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 333.35 g/mol, XLogP of 3.97, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1,3-benzoxazol-7-yl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 110356766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).