1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine

C16H20N2 — CID 116952210

IUPAC1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine
SMILESCNC(c1ccc(C)cc1)c1ccc(CN)cc1
InChIInChI=1S/C16H20N2/c1-12-3-7-14(8-4-12)16(18-2)15-9-5-13(11-17)6-10-15/h3-10,16,18H,11,17H2,1-2H3
InChIKeyLVAAJIIZSIINOI-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.76
Rot. Bonds4

About 1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine

1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine (PubChem CID 116952210) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine.

Molecular Properties

Compound Name1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine
PubChem CID116952210
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine
SMILESCNC(c1ccc(C)cc1)c1ccc(CN)cc1
InChIInChI=1S/C16H20N2/c1-12-3-7-14(8-4-12)16(18-2)15-9-5-13(11-17)6-10-15/h3-10,16,18H,11,17H2,1-2H3
InChIKeyLVAAJIIZSIINOI-UHFFFAOYSA-N
XLogP2.76
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-methylmethanamine;(4-methylphenyl)methanamine
CID 163390626
4-[(R)-methylamino-(4-methylphenyl)methyl]aniline
CID 90212370
1-[4-(aminomethyl)phenyl]-1-(3-bromophenyl)-N-methylmethanamine
CID 116952245
1-[3-(aminomethyl)phenyl]-1-(3,4-dimethylphenyl)-N-methylmethanamine
CID 116952153
1-[4-(aminomethyl)phenyl]-1-(2,5-difluorophenyl)-N-methylmethanamine
CID 116952228
1-(3,5-dibromophenyl)-N-methyl-1-(4-methylphenyl)methanamine
CID 114022838
1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methylphenyl)methanamine
CID 79704486
1-[3-(aminomethyl)phenyl]-N-methyl-1-(2,4,6-trimethylphenyl)methanamine
CID 116952167
1-(3,5-dimethoxyphenyl)-N-methyl-1-(4-methylphenyl)methanamine
CID 43481801
[4-[(4-methylphenyl)sulfanylmethyl]phenyl]methanamine
CID 43530260
1-(3-chloro-2-methylphenyl)-N-methyl-1-(4-methylphenyl)methanamine
CID 107096375
1-(2-bromo-3-methylphenyl)-N-methyl-1-(4-methylphenyl)methanamine
CID 107981867

Frequently Asked Questions

What is the IUPAC name of 1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine?
The IUPAC name of 1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine (CID 116952210) is 1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine.
What is the SMILES notation for 1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine?
The canonical SMILES for 1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine is CNC(c1ccc(C)cc1)c1ccc(CN)cc1.
What is the InChIKey of 1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine?
The InChIKey is LVAAJIIZSIINOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-12-3-7-14(8-4-12)16(18-2)15-9-5-13(11-17)6-10-15/h3-10,16,18H,11,17H2,1-2H3.
What are the key properties of 1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine?
1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine has a molecular weight of 240.35 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(aminomethyl)phenyl]-N-methyl-1-(4-methylphenyl)methanamine is sourced from PubChem (CID 116952210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).