3-[methoxy(methoxymethoxy)methyl]benzamide

C11H15NO4 — CID 91348805

IUPAC3-[methoxy(methoxymethoxy)methyl]benzamide
SMILESCOCOC(OC)c1cccc(C(N)=O)c1
InChIInChI=1S/C11H15NO4/c1-14-7-16-11(15-2)9-5-3-4-8(6-9)10(12)13/h3-6,11H,7H2,1-2H3,(H2,12,13)
InChIKeyYGYLPZMRDWYMHW-UHFFFAOYSA-N
MW225.24 g/mol
LogP1.05
Rot. Bonds6

About 3-[methoxy(methoxymethoxy)methyl]benzamide

3-[methoxy(methoxymethoxy)methyl]benzamide (PubChem CID 91348805) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is 3-[methoxy(methoxymethoxy)methyl]benzamide.

Molecular Properties

Compound Name3-[methoxy(methoxymethoxy)methyl]benzamide
PubChem CID91348805
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC Name3-[methoxy(methoxymethoxy)methyl]benzamide
SMILESCOCOC(OC)c1cccc(C(N)=O)c1
InChIInChI=1S/C11H15NO4/c1-14-7-16-11(15-2)9-5-3-4-8(6-9)10(12)13/h3-6,11H,7H2,1-2H3,(H2,12,13)
InChIKeyYGYLPZMRDWYMHW-UHFFFAOYSA-N
XLogP1.05
TPSA70.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-[methoxy(pyridin-4-ylmethoxy)methyl]benzamide
CID 91584519
3-[bromo(methoxy)methyl]benzamide
CID 57281068
3-[diethylsulfamoyl(methoxy)methyl]benzamide
CID 91128223
3-(dihydroxymethyl)benzamide
CID 174476205
3-(dimethoxymethyl)-N'-hydroxybenzenecarboximidamide
CID 145422329
3-[amino(hydroxy)methyl]benzamide
CID 140561822
methyl 4-(3-carbamoylphenyl)-3,4-dihydroxybutanoate
CID 171895716
1,2-di(propan-2-yl)benzene;3-propan-2-ylbenzamide
CID 170970604
4-[2-(dimethylamino)ethoxy-methoxymethyl]benzamide
CID 90899993
3-(1-hydroxy-3,3-dimethylpentyl)benzamide
CID 142840268
3-(4-amino-1,2-dihydroxybutyl)benzamide
CID 171881383
3-(1,2,4-trihydroxybutyl)benzamide
CID 171872426

Frequently Asked Questions

What is the IUPAC name of 3-[methoxy(methoxymethoxy)methyl]benzamide?
The IUPAC name of 3-[methoxy(methoxymethoxy)methyl]benzamide (CID 91348805) is 3-[methoxy(methoxymethoxy)methyl]benzamide.
What is the SMILES notation for 3-[methoxy(methoxymethoxy)methyl]benzamide?
The canonical SMILES for 3-[methoxy(methoxymethoxy)methyl]benzamide is COCOC(OC)c1cccc(C(N)=O)c1.
What is the InChIKey of 3-[methoxy(methoxymethoxy)methyl]benzamide?
The InChIKey is YGYLPZMRDWYMHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c1-14-7-16-11(15-2)9-5-3-4-8(6-9)10(12)13/h3-6,11H,7H2,1-2H3,(H2,12,13).
What are the key properties of 3-[methoxy(methoxymethoxy)methyl]benzamide?
3-[methoxy(methoxymethoxy)methyl]benzamide has a molecular weight of 225.24 g/mol, XLogP of 1.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methoxy(methoxymethoxy)methyl]benzamide is sourced from PubChem (CID 91348805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).