(4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine

C16H20N2O — CID 14978247

IUPAC(4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine
SMILESCNCc1ccccc1C(N)c1ccc(OC)cc1
InChIInChI=1S/C16H20N2O/c1-18-11-13-5-3-4-6-15(13)16(17)12-7-9-14(19-2)10-8-12/h3-10,16,18H,11,17H2,1-2H3
InChIKeyJLEIESCQBWIVLE-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.46
Rot. Bonds5

About (4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine

(4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine (PubChem CID 14978247) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is (4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine.

Molecular Properties

Compound Name(4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine
PubChem CID14978247
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name(4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine
SMILESCNCc1ccccc1C(N)c1ccc(OC)cc1
InChIInChI=1S/C16H20N2O/c1-18-11-13-5-3-4-6-15(13)16(17)12-7-9-14(19-2)10-8-12/h3-10,16,18H,11,17H2,1-2H3
InChIKeyJLEIESCQBWIVLE-UHFFFAOYSA-N
XLogP2.46
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methoxyphenyl)-(2-methylphenyl)methanamine
CID 24688459
[2-(2-methoxyethoxy)phenyl]-(4-methoxyphenyl)methanamine
CID 104659745
(2,5-dimethoxyphenyl)-(4-methoxyphenyl)methanamine
CID 43197203
1-(4-ethylphenyl)-N-[[2-[[2-[[(4-ethylphenyl)methylamino]methyl]phenyl]-(4-methoxyphenyl)methyl]phenyl]methyl]methanamine
CID 20537720
(2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine
CID 114102970
2-[[1-(4-methoxyphenyl)ethylamino]methyl]aniline
CID 66417891
(5-fluoro-2-methoxyphenyl)-(4-methoxyphenyl)methanamine
CID 43122364
1-(4-methoxyphenyl)-3-[2-(methylaminomethyl)phenyl]urea
CID 43602404
(4-butan-2-ylphenyl)-(4-methoxyphenyl)methanamine
CID 43198098
(S)-(2-methoxyphenyl)-[4-(trifluoromethoxy)phenyl]methanamine
CID 171239727
(2-bromo-4-methoxyphenyl)-phenylmethanamine
CID 60785941
(2-methoxyphenyl)-naphthalen-2-ylmethanamine
CID 62715547

Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine?
The IUPAC name of (4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine (CID 14978247) is (4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine.
What is the SMILES notation for (4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine?
The canonical SMILES for (4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine is CNCc1ccccc1C(N)c1ccc(OC)cc1.
What is the InChIKey of (4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine?
The InChIKey is JLEIESCQBWIVLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-18-11-13-5-3-4-6-15(13)16(17)12-7-9-14(19-2)10-8-12/h3-10,16,18H,11,17H2,1-2H3.
What are the key properties of (4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine?
(4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine has a molecular weight of 256.35 g/mol, XLogP of 2.46, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine is sourced from PubChem (CID 14978247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).