N-methoxy-N-methylbenzamide

C9H11NO2 — CID 569575

IUPACN-methoxy-N-methylbenzamide
SMILESCON(C)C(=O)c1ccccc1
InChIInChI=1S/C9H11NO2/c1-10(12-2)9(11)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeyUKERDACREYXSIV-UHFFFAOYSA-N
MW165.19 g/mol
LogP1.32
Rot. Bonds2

About N-methoxy-N-methylbenzamide

N-methoxy-N-methylbenzamide (PubChem CID 569575) has the molecular formula C9H11NO2 and a molecular weight of 165.19 g/mol. Its IUPAC name is N-methoxy-N-methylbenzamide.

Molecular Properties

Compound NameN-methoxy-N-methylbenzamide
PubChem CID569575
Molecular FormulaC9H11NO2
Molecular Weight165.19 g/mol
Exact Mass165.08
IUPAC NameN-methoxy-N-methylbenzamide
SMILESCON(C)C(=O)c1ccccc1
InChIInChI=1S/C9H11NO2/c1-10(12-2)9(11)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeyUKERDACREYXSIV-UHFFFAOYSA-N
XLogP1.32
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.19
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methylbenzamide?
The IUPAC name of N-methoxy-N-methylbenzamide (CID 569575) is N-methoxy-N-methylbenzamide.
What is the SMILES notation for N-methoxy-N-methylbenzamide?
The canonical SMILES for N-methoxy-N-methylbenzamide is CON(C)C(=O)c1ccccc1.
What is the InChIKey of N-methoxy-N-methylbenzamide?
The InChIKey is UKERDACREYXSIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2/c1-10(12-2)9(11)8-6-4-3-5-7-8/h3-7H,1-2H3.
What are the key properties of N-methoxy-N-methylbenzamide?
N-methoxy-N-methylbenzamide has a molecular weight of 165.19 g/mol, XLogP of 1.32, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methylbenzamide is sourced from PubChem (CID 569575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).