N-benzyl-2-methoxy-2-phenylethanamine

C16H19NO — CID 55038164

IUPACN-benzyl-2-methoxy-2-phenylethanamine
SMILESCOC(CNCc1ccccc1)c1ccccc1
InChIInChI=1S/C16H19NO/c1-18-16(15-10-6-3-7-11-15)13-17-12-14-8-4-2-5-9-14/h2-11,16-17H,12-13H2,1H3
InChIKeyVWGUTZRQAJEKBF-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.16
Rot. Bonds6

About N-benzyl-2-methoxy-2-phenylethanamine

N-benzyl-2-methoxy-2-phenylethanamine (PubChem CID 55038164) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is N-benzyl-2-methoxy-2-phenylethanamine.

Molecular Properties

Compound NameN-benzyl-2-methoxy-2-phenylethanamine
PubChem CID55038164
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC NameN-benzyl-2-methoxy-2-phenylethanamine
SMILESCOC(CNCc1ccccc1)c1ccccc1
InChIInChI=1S/C16H19NO/c1-18-16(15-10-6-3-7-11-15)13-17-12-14-8-4-2-5-9-14/h2-11,16-17H,12-13H2,1H3
InChIKeyVWGUTZRQAJEKBF-UHFFFAOYSA-N
XLogP3.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-2-methoxypropan-1-amine
CID 58887986
2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine
CID 55038163
2-[(2-methoxy-2-phenylethyl)amino]-1-phenylethanol
CID 110176855
N-iodo-2-methoxy-2-phenylethanamine
CID 175279844
N-benzyl-2-phenylbutan-1-amine
CID 60658494
(2S)-N-[(5-tert-butyl-1H-pyrazol-4-yl)methyl]-2-methoxy-2-phenylethanamine
CID 95580794
N-benzyl-2-methylpropan-1-amine;ethane
CID 142079167
N-benzyl-3-chloro-2-methylpropan-1-amine
CID 65031724
methyl (2S,3S)-2-[(benzylamino)methyl]-3-hydroxy-3-phenylpropanoate
CID 10086111
(2S)-1-(benzylamino)propan-2-ol
CID 964914
(2R)-1-N-benzyl-3-methoxy-2-N-methyl-2-N-[(1R)-1-phenylethyl]propane-1,2-diamine
CID 102413665
(2-benzylselanyl-1-methoxyethyl)benzene
CID 15257784

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-methoxy-2-phenylethanamine?
The IUPAC name of N-benzyl-2-methoxy-2-phenylethanamine (CID 55038164) is N-benzyl-2-methoxy-2-phenylethanamine.
What is the SMILES notation for N-benzyl-2-methoxy-2-phenylethanamine?
The canonical SMILES for N-benzyl-2-methoxy-2-phenylethanamine is COC(CNCc1ccccc1)c1ccccc1.
What is the InChIKey of N-benzyl-2-methoxy-2-phenylethanamine?
The InChIKey is VWGUTZRQAJEKBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-18-16(15-10-6-3-7-11-15)13-17-12-14-8-4-2-5-9-14/h2-11,16-17H,12-13H2,1H3.
What are the key properties of N-benzyl-2-methoxy-2-phenylethanamine?
N-benzyl-2-methoxy-2-phenylethanamine has a molecular weight of 241.33 g/mol, XLogP of 3.16, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-methoxy-2-phenylethanamine is sourced from PubChem (CID 55038164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).