3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide

C14H16N2O4 — CID 110714594

IUPAC3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide
SMILESCOc1ccc(C(=O)NCc2coc(C)n2)cc1OC
InChIInChI=1S/C14H16N2O4/c1-9-16-11(8-20-9)7-15-14(17)10-4-5-12(18-2)13(6-10)19-3/h4-6,8H,7H2,1-3H3,(H,15,17)
InChIKeyWRRBUVHXHZZASE-UHFFFAOYSA-N
MW276.29 g/mol
LogP1.93
Rot. Bonds5

About 3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide

3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide (PubChem CID 110714594) has the molecular formula C14H16N2O4 and a molecular weight of 276.29 g/mol. Its IUPAC name is 3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide.

Molecular Properties

Compound Name3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide
PubChem CID110714594
Molecular FormulaC14H16N2O4
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC Name3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide
SMILESCOc1ccc(C(=O)NCc2coc(C)n2)cc1OC
InChIInChI=1S/C14H16N2O4/c1-9-16-11(8-20-9)7-15-14(17)10-4-5-12(18-2)13(6-10)19-3/h4-6,8H,7H2,1-3H3,(H,15,17)
InChIKeyWRRBUVHXHZZASE-UHFFFAOYSA-N
XLogP1.93
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,4-dimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide
CID 110714591
3-(3,4-dimethoxyphenyl)-N-[(2-methyl-1,3-oxazol-4-yl)methyl]propanamide
CID 110742436
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3,4-dimethoxybenzamide
CID 87043417
N-[[3-[[(3,4-dimethoxybenzoyl)amino]methyl]phenyl]methyl]-3,4-dimethoxybenzamide
CID 2841934
methyl 2-[2-methoxy-4-[(2-methyl-1,3-thiazol-4-yl)methylcarbamoyl]phenoxy]acetate
CID 55866346
3,4-dimethoxy-N-[[2-(4-methylphenyl)-5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl]benzamide
CID 50777977
3-bromo-4-methoxy-N-[(2-methyl-1,3-thiazol-4-yl)methyl]benzamide
CID 47290705
N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide
CID 110783214
N-[(2-ethylpyrazol-3-yl)methyl]-3,4-dimethoxybenzamide
CID 19294681
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-4-methoxybenzamide
CID 87043362
N-[[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl]naphthalene-2-carboxamide
CID 16867283
3,4-dimethoxy-N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]benzamide
CID 71691502

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide?
The IUPAC name of 3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide (CID 110714594) is 3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide.
What is the SMILES notation for 3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide?
The canonical SMILES for 3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide is COc1ccc(C(=O)NCc2coc(C)n2)cc1OC.
What is the InChIKey of 3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide?
The InChIKey is WRRBUVHXHZZASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4/c1-9-16-11(8-20-9)7-15-14(17)10-4-5-12(18-2)13(6-10)19-3/h4-6,8H,7H2,1-3H3,(H,15,17).
What are the key properties of 3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide?
3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide has a molecular weight of 276.29 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide is sourced from PubChem (CID 110714594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).