1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine

C16H19NO2 — CID 22278186

IUPAC1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine
SMILESCOC(NC(OC)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H19NO2/c1-18-15(13-9-5-3-6-10-13)17-16(19-2)14-11-7-4-8-12-14/h3-12,15-17H,1-2H3
InChIKeyXUNGLLQAIXMNJD-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.27
Rot. Bonds6

About 1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine

1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine (PubChem CID 22278186) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine.

Molecular Properties

Compound Name1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine
PubChem CID22278186
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine
SMILESCOC(NC(OC)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H19NO2/c1-18-15(13-9-5-3-6-10-13)17-16(19-2)14-11-7-4-8-12-14/h3-12,15-17H,1-2H3
InChIKeyXUNGLLQAIXMNJD-UHFFFAOYSA-N
XLogP3.27
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1,1-dimethoxy-N-[(1R)-1-phenylethyl]propan-2-amine
CID 81351773
N,N,1-trimethoxy-1-phenylmethanamine
CID 87073400
[2-[[methoxy(phenyl)methyl]amino]-2-oxo-1-phenylethyl] acetate
CID 14186661
[(2R)-2-methoxy-1-phenylpropyl]benzene
CID 101223865
6-chloro-4-iodo-N-[methoxy(phenyl)methyl]pyridin-2-amine
CID 155658785
[(1R)-1-bromo-2,2-dimethoxyethyl]benzene
CID 129364228
N-iodo-2-methoxy-2-phenylethanamine
CID 175279844
(2S)-2-[(2-methoxy-2-phenylacetyl)amino]propanoic acid
CID 78986376
benzene;[(1R)-1,2-dimethoxyethyl]benzene
CID 178156280
1-methoxyprop-2-enylbenzene
CID 11029990
(2R)-2-methoxy-2-phenylethanol
CID 6950345
(2,2,2-trifluoro-1-methoxyethyl)benzene
CID 15275027

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine?
The IUPAC name of 1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine (CID 22278186) is 1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine.
What is the SMILES notation for 1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine?
The canonical SMILES for 1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine is COC(NC(OC)c1ccccc1)c1ccccc1.
What is the InChIKey of 1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine?
The InChIKey is XUNGLLQAIXMNJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-18-15(13-9-5-3-6-10-13)17-16(19-2)14-11-7-4-8-12-14/h3-12,15-17H,1-2H3.
What are the key properties of 1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine?
1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine has a molecular weight of 257.33 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-[methoxy(phenyl)methyl]-1-phenylmethanamine is sourced from PubChem (CID 22278186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).