2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide

C19H20N2O4 — CID 50796641

IUPAC2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide
SMILESCCCn1c(=O)oc2cc(NC(=O)COc3ccc(C)cc3)ccc21
InChIInChI=1S/C19H20N2O4/c1-3-10-21-16-9-6-14(11-17(16)25-19(21)23)20-18(22)12-24-15-7-4-13(2)5-8-15/h4-9,11H,3,10,12H2,1-2H3,(H,20,22)
InChIKeyWOXZSGUKWUEOPE-UHFFFAOYSA-N
MW340.38 g/mol
LogP3.33
Rot. Bonds6

About 2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide

2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide (PubChem CID 50796641) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is 2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide.

Molecular Properties

Compound Name2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide
PubChem CID50796641
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC Name2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide
SMILESCCCn1c(=O)oc2cc(NC(=O)COc3ccc(C)cc3)ccc21
InChIInChI=1S/C19H20N2O4/c1-3-10-21-16-9-6-14(11-17(16)25-19(21)23)20-18(22)12-24-15-7-4-13(2)5-8-15/h4-9,11H,3,10,12H2,1-2H3,(H,20,22)
InChIKeyWOXZSGUKWUEOPE-UHFFFAOYSA-N
XLogP3.33
TPSA73.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methylphenoxy)-N-(2-oxo-3-propan-2-yl-1,3-benzoxazol-6-yl)acetamide
CID 50797086
1-(4-methoxyphenyl)-3-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)urea
CID 50797054
1-(3,5-dimethoxyphenyl)-3-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)urea
CID 50797367
1-(2-methoxy-5-methylphenyl)-3-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)urea
CID 50797422
1-(4-chlorophenyl)-3-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)urea
CID 50796890
2-(4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 681889
N-[3-[2-(dimethylamino)ethyl]-2-oxo-1,3-benzoxazol-5-yl]-2-(4-fluorophenoxy)acetamide
CID 51128831
N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-2-(4-methylphenyl)acetamide
CID 110662181
N-(2-methyl-1,3-benzoxazol-6-yl)-2-(4-methylphenoxy)acetamide
CID 110729012
2-(4-methylphenoxy)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide
CID 37093998
2-(4-butoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 4732728
2-(4-methylphenoxy)-N-(4-propoxyphenyl)acetamide
CID 4943007

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide?
The IUPAC name of 2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide (CID 50796641) is 2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide.
What is the SMILES notation for 2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide?
The canonical SMILES for 2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide is CCCn1c(=O)oc2cc(NC(=O)COc3ccc(C)cc3)ccc21.
What is the InChIKey of 2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide?
The InChIKey is WOXZSGUKWUEOPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-3-10-21-16-9-6-14(11-17(16)25-19(21)23)20-18(22)12-24-15-7-4-13(2)5-8-15/h4-9,11H,3,10,12H2,1-2H3,(H,20,22).
What are the key properties of 2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide?
2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide has a molecular weight of 340.38 g/mol, XLogP of 3.33, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenoxy)-N-(2-oxo-3-propyl-1,3-benzoxazol-6-yl)acetamide is sourced from PubChem (CID 50796641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).