3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide

C22H24N2O3 — CID 51188159

IUPAC3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide
SMILESCc1noc(C)c1COc1cccc(C(=O)N(C)C(C)c2ccccc2)c1
InChIInChI=1S/C22H24N2O3/c1-15-21(17(3)27-23-15)14-26-20-12-8-11-19(13-20)22(25)24(4)16(2)18-9-6-5-7-10-18/h5-13,16H,14H2,1-4H3
InChIKeyUKHQANVWCPLCGT-UHFFFAOYSA-N
MW364.45 g/mol
LogP4.70
Rot. Bonds6

About 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide

3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide (PubChem CID 51188159) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide.

Molecular Properties

Compound Name3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide
PubChem CID51188159
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC Name3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide
SMILESCc1noc(C)c1COc1cccc(C(=O)N(C)C(C)c2ccccc2)c1
InChIInChI=1S/C22H24N2O3/c1-15-21(17(3)27-23-15)14-26-20-12-8-11-19(13-20)22(25)24(4)16(2)18-9-6-5-7-10-18/h5-13,16H,14H2,1-4H3
InChIKeyUKHQANVWCPLCGT-UHFFFAOYSA-N
XLogP4.70
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide?
The IUPAC name of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide (CID 51188159) is 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide.
What is the SMILES notation for 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide?
The canonical SMILES for 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide is Cc1noc(C)c1COc1cccc(C(=O)N(C)C(C)c2ccccc2)c1.
What is the InChIKey of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide?
The InChIKey is UKHQANVWCPLCGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-15-21(17(3)27-23-15)14-26-20-12-8-11-19(13-20)22(25)24(4)16(2)18-9-6-5-7-10-18/h5-13,16H,14H2,1-4H3.
What are the key properties of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide?
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide has a molecular weight of 364.45 g/mol, XLogP of 4.70, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide is sourced from PubChem (CID 51188159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).