N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine

C16H19N — CID 21395132

IUPACN-methyl-1-[4-(2-phenylethyl)phenyl]methanamine
SMILESCNCc1ccc(CCc2ccccc2)cc1
InChIInChI=1S/C16H19N/c1-17-13-16-11-9-15(10-12-16)8-7-14-5-3-2-4-6-14/h2-6,9-12,17H,7-8,13H2,1H3
InChIKeyYCZOZMILZCUARP-UHFFFAOYSA-N
MW225.33 g/mol
LogP3.19
Rot. Bonds5

About N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine

N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine (PubChem CID 21395132) has the molecular formula C16H19N and a molecular weight of 225.33 g/mol. Its IUPAC name is N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[4-(2-phenylethyl)phenyl]methanamine
PubChem CID21395132
Molecular FormulaC16H19N
Molecular Weight225.33 g/mol
Exact Mass225.15
IUPAC NameN-methyl-1-[4-(2-phenylethyl)phenyl]methanamine
SMILESCNCc1ccc(CCc2ccccc2)cc1
InChIInChI=1S/C16H19N/c1-17-13-16-11-9-15(10-12-16)8-7-14-5-3-2-4-6-14/h2-6,9-12,17H,7-8,13H2,1H3
InChIKeyYCZOZMILZCUARP-UHFFFAOYSA-N
XLogP3.19
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

borane;N-methyl-1-phenylmethanamine
CID 134979061
N-methyl-1-phenylmethanamine;hydrate;hydrochloride
CID 174315758
N-methyl-1-(4-propylphenyl)methanamine
CID 20666221
N-[[4-(2-phenylethyl)phenyl]methyl]ethanamine
CID 70892466
1-benzyl-4-[2-(4-benzylphenyl)ethyl]benzene
CID 23565947
ethane;N-methyl-2-[4-(methylaminomethyl)phenyl]ethanamine
CID 145117697
ethane;N-methyl-1-(4-propylphenyl)methanamine
CID 176699852
ethane;formaldehyde;N-methyl-1-phenylmethanamine;methylsulfanylmethane
CID 143717501
benzene;2-phenylethylbenzene
CID 18982764
3-[4-(methylaminomethyl)phenyl]propanoic acid
CID 138583919
ethane;methane;2-phenylethylbenzene
CID 158652330
N-methylmethanamine;N-methyl-2-phenylethanamine
CID 22563284

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine?
The IUPAC name of N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine (CID 21395132) is N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine.
What is the SMILES notation for N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine?
The canonical SMILES for N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine is CNCc1ccc(CCc2ccccc2)cc1.
What is the InChIKey of N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine?
The InChIKey is YCZOZMILZCUARP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-17-13-16-11-9-15(10-12-16)8-7-14-5-3-2-4-6-14/h2-6,9-12,17H,7-8,13H2,1H3.
What are the key properties of N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine?
N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine has a molecular weight of 225.33 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine is sourced from PubChem (CID 21395132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).