N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide

C17H19N3O4 — CID 139963429

IUPACN-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide
SMILESCCc1nc2c(OC)ccc(CC(=O)Nc3c(C)noc3C)c2o1
InChIInChI=1S/C17H19N3O4/c1-5-14-19-16-12(22-4)7-6-11(17(16)23-14)8-13(21)18-15-9(2)20-24-10(15)3/h6-7H,5,8H2,1-4H3,(H,18,21)
InChIKeyLWDSDIPKGJJWFF-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.18
Rot. Bonds5

About N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide

N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide (PubChem CID 139963429) has the molecular formula C17H19N3O4 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide
PubChem CID139963429
Molecular FormulaC17H19N3O4
Molecular Weight329.36 g/mol
Exact Mass329.14
IUPAC NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide
SMILESCCc1nc2c(OC)ccc(CC(=O)Nc3c(C)noc3C)c2o1
InChIInChI=1S/C17H19N3O4/c1-5-14-19-16-12(22-4)7-6-11(17(16)23-14)8-13(21)18-15-9(2)20-24-10(15)3/h6-7H,5,8H2,1-4H3,(H,18,21)
InChIKeyLWDSDIPKGJJWFF-UHFFFAOYSA-N
XLogP3.18
TPSA90.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide with MolForge

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Related Compounds

2-[4-(difluoromethoxy)-2-ethyl-1,3-benzoxazol-7-yl]-N-[5-methyl-3-(trifluoromethyl)-1,2-oxazol-4-yl]acetamide
CID 139963430
N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide
CID 51098103
1-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[(2-methoxyphenyl)methyl]urea
CID 75462467
1-[(3,4-dimethoxyphenyl)methyl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)urea
CID 52793572
N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-methoxy-2-piperazin-1-yl-1,3-benzothiazole-7-carboxamide
CID 10141792
2-(2,6-dichlorophenyl)-N-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 51098104
1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-[5-(5-ethyl-1,3,4-oxadiazol-2-yl)-2-methoxyphenyl]urea
CID 74240670
N-(2-ethoxy-4,6-dimethylpyrimidin-5-yl)-2-(4-methoxy-3-methylphenyl)acetamide
CID 122356063
N-(2,5-dimethoxyphenyl)-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 30273731
2-(4-ethylphenyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)acetamide
CID 16824377
N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(methoxymethyl)benzamide
CID 60600533
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-methoxy-6-methyl-2-pyridinyl)butanamide
CID 138993062

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide?
The IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide (CID 139963429) is N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide.
What is the SMILES notation for N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide?
The canonical SMILES for N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide is CCc1nc2c(OC)ccc(CC(=O)Nc3c(C)noc3C)c2o1.
What is the InChIKey of N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide?
The InChIKey is LWDSDIPKGJJWFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O4/c1-5-14-19-16-12(22-4)7-6-11(17(16)23-14)8-13(21)18-15-9(2)20-24-10(15)3/h6-7H,5,8H2,1-4H3,(H,18,21).
What are the key properties of N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide?
N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide has a molecular weight of 329.36 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-ethyl-4-methoxy-1,3-benzoxazol-7-yl)acetamide is sourced from PubChem (CID 139963429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).