4-[(dimethylamino)methyl]-N-methylaniline

C10H16N2 — CID 59619039

IUPAC4-[(dimethylamino)methyl]-N-methylaniline
SMILESCNc1ccc(CN(C)C)cc1
InChIInChI=1S/C10H16N2/c1-11-10-6-4-9(5-7-10)8-12(2)3/h4-7,11H,8H2,1-3H3
InChIKeyKMQLUFMUJJSNJJ-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.79
Rot. Bonds3

About 4-[(dimethylamino)methyl]-N-methylaniline

4-[(dimethylamino)methyl]-N-methylaniline (PubChem CID 59619039) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 4-[(dimethylamino)methyl]-N-methylaniline.

Molecular Properties

Compound Name4-[(dimethylamino)methyl]-N-methylaniline
PubChem CID59619039
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name4-[(dimethylamino)methyl]-N-methylaniline
SMILESCNc1ccc(CN(C)C)cc1
InChIInChI=1S/C10H16N2/c1-11-10-6-4-9(5-7-10)8-12(2)3/h4-7,11H,8H2,1-3H3
InChIKeyKMQLUFMUJJSNJJ-UHFFFAOYSA-N
XLogP1.79
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-4-[[4-(methylamino)phenyl]methyl]aniline
CID 15735
4-[(4-fluoro-N-methylanilino)methyl]-N-methylaniline
CID 115212690
4-[(4-chloro-N-methylanilino)methyl]-N-methylaniline
CID 115212691
4-[(4-methoxy-N-methylanilino)methyl]-N-methylaniline
CID 115212693
N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine
CID 91426963
4-[(dimethylamino)methyl]-N-(2,6-dimethylheptan-4-yl)aniline
CID 43747152
N-methyl-N-[[4-(methylamino)phenyl]methyl]-1H-pyrrol-2-amine
CID 115212707
ethane;1-(4-ethylphenyl)-N,N-dimethylmethanamine
CID 143652476
[4-[(dimethylamino)methyl]anilino]urea
CID 174921492
N-cyclohexyl-4-[(dimethylamino)methyl]aniline
CID 43747284
N-[4-[(dimethylamino)methyl]phenyl]propane-1-sulfonamide
CID 64585715
1-N,4-N-dimethyl-4-N-[4-(methylamino)phenyl]benzene-1,4-diamine
CID 21331414

Frequently Asked Questions

What is the IUPAC name of 4-[(dimethylamino)methyl]-N-methylaniline?
The IUPAC name of 4-[(dimethylamino)methyl]-N-methylaniline (CID 59619039) is 4-[(dimethylamino)methyl]-N-methylaniline.
What is the SMILES notation for 4-[(dimethylamino)methyl]-N-methylaniline?
The canonical SMILES for 4-[(dimethylamino)methyl]-N-methylaniline is CNc1ccc(CN(C)C)cc1.
What is the InChIKey of 4-[(dimethylamino)methyl]-N-methylaniline?
The InChIKey is KMQLUFMUJJSNJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-11-10-6-4-9(5-7-10)8-12(2)3/h4-7,11H,8H2,1-3H3.
What are the key properties of 4-[(dimethylamino)methyl]-N-methylaniline?
4-[(dimethylamino)methyl]-N-methylaniline has a molecular weight of 164.25 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylamino)methyl]-N-methylaniline is sourced from PubChem (CID 59619039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).