2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline

C11H18N2O — CID 177239410

IUPAC2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline
SMILESCNCc1cc(NC)c(OC)cc1C
InChIInChI=1S/C11H18N2O/c1-8-5-11(14-4)10(13-3)6-9(8)7-12-2/h5-6,12-13H,7H2,1-4H3
InChIKeyYDXZKQHMGBWEJF-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.76
Rot. Bonds4

About 2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline

2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline (PubChem CID 177239410) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline.

Molecular Properties

Compound Name2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline
PubChem CID177239410
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline
SMILESCNCc1cc(NC)c(OC)cc1C
InChIInChI=1S/C11H18N2O/c1-8-5-11(14-4)10(13-3)6-9(8)7-12-2/h5-6,12-13H,7H2,1-4H3
InChIKeyYDXZKQHMGBWEJF-UHFFFAOYSA-N
XLogP1.76
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-5-methyl-4-(methylaminomethyl)phenol
CID 105422769
2-methoxy-1-N,4-N,5-trimethylbenzene-1,4-diamine
CID 146951235
1-(3,5-dimethoxy-2-methylphenyl)-N-methylmethanamine
CID 84666309
N'-[(4,5-dimethoxy-2-methylphenyl)methyl]-N-methylpropane-1,3-diamine
CID 115197854
N'-[(5-chloro-4-methoxy-2-methylphenyl)methyl]-N-methylmethanediamine
CID 89373836
[(4-methoxy-2,5-dimethylphenyl)methylamino]methanethiol
CID 115227904
N-[(4,5-dimethoxy-2-methylphenyl)methyl]cyclobutanamine
CID 96674047
1-(4-methoxy-6-methyl-3-pyridinyl)-N-methylmethanamine
CID 81254703
4-methoxy-2-methyl-6-(methylaminomethyl)phenol
CID 84657983
1-[2-(3,4-dimethylphenyl)-4,5-dimethoxyphenyl]-N-methylmethanamine
CID 61032532
N'-[2-(4,5-dimethoxy-2-methylphenyl)ethyl]-N-methylmethanediamine
CID 115227195
5-chloro-2,4-dimethoxy-N-methylaniline
CID 28576065

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline?
The IUPAC name of 2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline (CID 177239410) is 2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline.
What is the SMILES notation for 2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline?
The canonical SMILES for 2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline is CNCc1cc(NC)c(OC)cc1C.
What is the InChIKey of 2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline?
The InChIKey is YDXZKQHMGBWEJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-8-5-11(14-4)10(13-3)6-9(8)7-12-2/h5-6,12-13H,7H2,1-4H3.
What are the key properties of 2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline?
2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline has a molecular weight of 194.28 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,4-dimethyl-5-(methylaminomethyl)aniline is sourced from PubChem (CID 177239410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).