N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline

C17H22N2 — CID 61411671

IUPACN-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline
SMILESCNCc1ccccc1N(C)Cc1cccc(C)c1
InChIInChI=1S/C17H22N2/c1-14-7-6-8-15(11-14)13-19(3)17-10-5-4-9-16(17)12-18-2/h4-11,18H,12-13H2,1-3H3
InChIKeyOXJZCWOLDGPLJJ-UHFFFAOYSA-N
MW254.38 g/mol
LogP3.35
Rot. Bonds5

About N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline

N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline (PubChem CID 61411671) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline.

Molecular Properties

Compound NameN-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline
PubChem CID61411671
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC NameN-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline
SMILESCNCc1ccccc1N(C)Cc1cccc(C)c1
InChIInChI=1S/C17H22N2/c1-14-7-6-8-15(11-14)13-19(3)17-10-5-4-9-16(17)12-18-2/h4-11,18H,12-13H2,1-3H3
InChIKeyOXJZCWOLDGPLJJ-UHFFFAOYSA-N
XLogP3.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine
CID 81246986
N-[(3-methoxyphenyl)methyl]-N-methyl-2-(methylaminomethyl)aniline
CID 61417843
3-chloro-N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline
CID 61411575
N,3-dimethyl-N-[[2-(methylaminomethyl)phenyl]methyl]aniline
CID 62434976
N-benzyl-4-fluoro-N-methyl-2-(methylaminomethyl)aniline
CID 43313736
N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine
CID 62289611
(1R)-1-[2-[methyl-[(3-methylphenyl)methyl]amino]phenyl]propan-1-ol
CID 103959816
(1S)-1-[2-[methyl-[(3-methylphenyl)methyl]amino]phenyl]propan-1-ol
CID 103959815
N,N,N'-trimethyl-N'-[2-(methylaminomethyl)phenyl]ethane-1,2-diamine
CID 63699905
2-(chloromethyl)-4-fluoro-N-methyl-N-[(3-methylphenyl)methyl]aniline
CID 63540677
N-methyl-N-[(3-methylphenyl)methyl]-3-(propylaminomethyl)pyridin-4-amine
CID 81253106
N-benzyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline
CID 43280656

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline?
The IUPAC name of N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline (CID 61411671) is N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline.
What is the SMILES notation for N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline?
The canonical SMILES for N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline is CNCc1ccccc1N(C)Cc1cccc(C)c1.
What is the InChIKey of N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline?
The InChIKey is OXJZCWOLDGPLJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-14-7-6-8-15(11-14)13-19(3)17-10-5-4-9-16(17)12-18-2/h4-11,18H,12-13H2,1-3H3.
What are the key properties of N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline?
N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline has a molecular weight of 254.38 g/mol, XLogP of 3.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline is sourced from PubChem (CID 61411671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).