N-methoxy-N-methyl-4-(methylamino)benzamide

C10H14N2O2 — CID 130666687

IUPACN-methoxy-N-methyl-4-(methylamino)benzamide
SMILESCNc1ccc(C(=O)N(C)OC)cc1
InChIInChI=1S/C10H14N2O2/c1-11-9-6-4-8(5-7-9)10(13)12(2)14-3/h4-7,11H,1-3H3
InChIKeyVAVUAKHYNIUJCD-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.36
Rot. Bonds3

About N-methoxy-N-methyl-4-(methylamino)benzamide

N-methoxy-N-methyl-4-(methylamino)benzamide (PubChem CID 130666687) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is N-methoxy-N-methyl-4-(methylamino)benzamide.

Molecular Properties

Compound NameN-methoxy-N-methyl-4-(methylamino)benzamide
PubChem CID130666687
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC NameN-methoxy-N-methyl-4-(methylamino)benzamide
SMILESCNc1ccc(C(=O)N(C)OC)cc1
InChIInChI=1S/C10H14N2O2/c1-11-9-6-4-8(5-7-9)10(13)12(2)14-3/h4-7,11H,1-3H3
InChIKeyVAVUAKHYNIUJCD-UHFFFAOYSA-N
XLogP1.36
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-methyl-4-(methylamino)benzamide?
The IUPAC name of N-methoxy-N-methyl-4-(methylamino)benzamide (CID 130666687) is N-methoxy-N-methyl-4-(methylamino)benzamide.
What is the SMILES notation for N-methoxy-N-methyl-4-(methylamino)benzamide?
The canonical SMILES for N-methoxy-N-methyl-4-(methylamino)benzamide is CNc1ccc(C(=O)N(C)OC)cc1.
What is the InChIKey of N-methoxy-N-methyl-4-(methylamino)benzamide?
The InChIKey is VAVUAKHYNIUJCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-11-9-6-4-8(5-7-9)10(13)12(2)14-3/h4-7,11H,1-3H3.
What are the key properties of N-methoxy-N-methyl-4-(methylamino)benzamide?
N-methoxy-N-methyl-4-(methylamino)benzamide has a molecular weight of 194.23 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-4-(methylamino)benzamide is sourced from PubChem (CID 130666687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).