2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline

C11H18N2O — CID 84754595

IUPAC2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline
SMILESCNCc1ccc(N(C)C)c(OC)c1
InChIInChI=1S/C11H18N2O/c1-12-8-9-5-6-10(13(2)3)11(7-9)14-4/h5-7,12H,8H2,1-4H3
InChIKeyGAGJQSCQOHEIQA-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.48
Rot. Bonds4

About 2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline

2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline (PubChem CID 84754595) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline.

Molecular Properties

Compound Name2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline
PubChem CID84754595
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline
SMILESCNCc1ccc(N(C)C)c(OC)c1
InChIInChI=1S/C11H18N2O/c1-12-8-9-5-6-10(13(2)3)11(7-9)14-4/h5-7,12H,8H2,1-4H3
InChIKeyGAGJQSCQOHEIQA-UHFFFAOYSA-N
XLogP1.48
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-4-[[(4-methoxyphenyl)methylamino]methyl]-N,N-dimethylaniline
CID 84754579
2-methoxy-4-(methylaminomethyl)-N,N-dipropylaniline
CID 84754258
2-methoxy-N,N-dimethyl-4-[(2-methylpropylamino)methyl]aniline
CID 84754564
3-[N-ethyl-2-methoxy-4-(methylaminomethyl)anilino]propanoic acid
CID 84754729
2-methoxy-N-methyl-4-(methylaminomethyl)-N-propan-2-ylbenzenesulfonamide
CID 102704328
N-[[4-(dimethylamino)-3-methoxyphenyl]methyl]-N-methylcarbamoyl iodide
CID 146274343
methyl 2-[2-methoxy-4-(methylaminomethyl)phenoxy]acetate
CID 60882991
1-[3-methoxy-4-(trifluoromethyl)phenyl]-N-methylmethanamine;hydrochloride
CID 155970638
1-(4-methoxy-3-propoxyphenyl)-N-methylmethanamine
CID 15079025
N-methyl-1-(3,4,5-trimethoxyphenyl)methanamine
CID 521855
bicyclo[4.2.0]octa-1,3,5-triene;1-(3,4-dimethoxyphenyl)-N-methylmethanamine
CID 174695660
1-(3-methoxy-4-nitrophenyl)-N-methylmethanamine
CID 62114292

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline?
The IUPAC name of 2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline (CID 84754595) is 2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline.
What is the SMILES notation for 2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline?
The canonical SMILES for 2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline is CNCc1ccc(N(C)C)c(OC)c1.
What is the InChIKey of 2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline?
The InChIKey is GAGJQSCQOHEIQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-12-8-9-5-6-10(13(2)3)11(7-9)14-4/h5-7,12H,8H2,1-4H3.
What are the key properties of 2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline?
2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline has a molecular weight of 194.28 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,N-dimethyl-4-(methylaminomethyl)aniline is sourced from PubChem (CID 84754595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).