N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide

C14H16N2O4 — CID 51098103

IUPACN-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2c(C)noc2C)cc1OC
InChIInChI=1S/C14H16N2O4/c1-8-13(9(2)20-16-8)15-14(17)10-5-6-11(18-3)12(7-10)19-4/h5-7H,1-4H3,(H,15,17)
InChIKeyALIQCMHMESYIOA-UHFFFAOYSA-N
MW276.29 g/mol
LogP2.56
Rot. Bonds4

About N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide

N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide (PubChem CID 51098103) has the molecular formula C14H16N2O4 and a molecular weight of 276.29 g/mol. Its IUPAC name is N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide
PubChem CID51098103
Molecular FormulaC14H16N2O4
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2c(C)noc2C)cc1OC
InChIInChI=1S/C14H16N2O4/c1-8-13(9(2)20-16-8)15-14(17)10-5-6-11(18-3)12(7-10)19-4/h5-7H,1-4H3,(H,15,17)
InChIKeyALIQCMHMESYIOA-UHFFFAOYSA-N
XLogP2.56
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(3,4-dimethoxyphenyl)methyl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)urea
CID 52793572
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3,4-dimethoxybenzamide
CID 110646263
N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(methoxymethyl)benzamide
CID 60600533
N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-3,4-dimethoxybenzamide
CID 122356456
N-(2-amino-6-methylphenyl)-3,4-dimethoxybenzamide
CID 43330049
N-(3,4-dimethoxyphenyl)-3,5-dimethyl-1,2-oxazole-4-carboxamide
CID 1245318
3,4-dimethoxy-N-(1,2-oxazol-3-yl)benzamide
CID 17217711
N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-nitrobenzamide
CID 102468027
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxy-N-[4-(2-methoxyethoxy)phenyl]benzamide
CID 46433797
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3,4-dimethoxybenzamide
CID 87043417
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxy-N'-(4-methoxybenzoyl)benzohydrazide
CID 2093118
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(3-fluorophenyl)-3-methoxybenzamide
CID 26086460

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide?
The IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide (CID 51098103) is N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide.
What is the SMILES notation for N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide?
The canonical SMILES for N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide is COc1ccc(C(=O)Nc2c(C)noc2C)cc1OC.
What is the InChIKey of N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide?
The InChIKey is ALIQCMHMESYIOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4/c1-8-13(9(2)20-16-8)15-14(17)10-5-6-11(18-3)12(7-10)19-4/h5-7H,1-4H3,(H,15,17).
What are the key properties of N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide?
N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide has a molecular weight of 276.29 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1,2-oxazol-4-yl)-3,4-dimethoxybenzamide is sourced from PubChem (CID 51098103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).