2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline

C12H20N2O — CID 117107462

IUPAC2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline
SMILESCONCc1cc(C)c(C)cc1N(C)C
InChIInChI=1S/C12H20N2O/c1-9-6-11(8-13-15-5)12(14(3)4)7-10(9)2/h6-7,13H,8H2,1-5H3
InChIKeyFMNYVPKXCMLLKU-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.02
Rot. Bonds4

About 2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline

2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline (PubChem CID 117107462) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline.

Molecular Properties

Compound Name2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline
PubChem CID117107462
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline
SMILESCONCc1cc(C)c(C)cc1N(C)C
InChIInChI=1S/C12H20N2O/c1-9-6-11(8-13-15-5)12(14(3)4)7-10(9)2/h6-7,13H,8H2,1-5H3
InChIKeyFMNYVPKXCMLLKU-UHFFFAOYSA-N
XLogP2.02
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline?
The IUPAC name of 2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline (CID 117107462) is 2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline.
What is the SMILES notation for 2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline?
The canonical SMILES for 2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline is CONCc1cc(C)c(C)cc1N(C)C.
What is the InChIKey of 2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline?
The InChIKey is FMNYVPKXCMLLKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-9-6-11(8-13-15-5)12(14(3)4)7-10(9)2/h6-7,13H,8H2,1-5H3.
What are the key properties of 2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline?
2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline has a molecular weight of 208.30 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(methoxyamino)methyl]-N,N,4,5-tetramethylaniline is sourced from PubChem (CID 117107462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).