2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine

C17H21NO2 — CID 116772779

IUPAC2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine
SMILESCOc1ccc(C)cc1C(N)C(OC)c1ccccc1
InChIInChI=1S/C17H21NO2/c1-12-9-10-15(19-2)14(11-12)16(18)17(20-3)13-7-5-4-6-8-13/h4-11,16-17H,18H2,1-3H3
InChIKeyXOLXDPXEVBEWMU-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.39
Rot. Bonds5

About 2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine

2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine (PubChem CID 116772779) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine.

Molecular Properties

Compound Name2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine
PubChem CID116772779
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine
SMILESCOc1ccc(C)cc1C(N)C(OC)c1ccccc1
InChIInChI=1S/C17H21NO2/c1-12-9-10-15(19-2)14(11-12)16(18)17(20-3)13-7-5-4-6-8-13/h4-11,16-17H,18H2,1-3H3
InChIKeyXOLXDPXEVBEWMU-UHFFFAOYSA-N
XLogP3.39
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-1-(4-methoxy-2,5-dimethylphenyl)-2-phenylethanamine
CID 116772886
1-(3,5-dimethylphenyl)-2-methoxy-2-phenylethanamine
CID 116772917
1-(2-methoxy-5-methylphenyl)-2-(2-methoxyphenoxy)ethanamine
CID 16785142
1-(2-methoxy-5-methylphenyl)-2-methylpropane-1,3-diamine
CID 116933048
1-(2-methoxy-5-methylphenyl)-2-(2-methylphenyl)sulfanylethanamine
CID 64649874
(2S)-2-amino-2-(2-methoxy-5-methylphenyl)ethanol
CID 55278412
2-methoxy-2-phenyl-1-[2-(trifluoromethyl)phenyl]ethanamine
CID 116772777
2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine
CID 83155175
(2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine
CID 43626072
(1R)-1-(2-methoxy-5-methylphenyl)butan-1-amine
CID 55278250
1-(2,5-difluorophenyl)-2-methoxy-2-phenylethanamine
CID 116772931
1-methoxy-2-(1-methoxyethyl)-4-methylbenzene
CID 71396401

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine?
The IUPAC name of 2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine (CID 116772779) is 2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine.
What is the SMILES notation for 2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine?
The canonical SMILES for 2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine is COc1ccc(C)cc1C(N)C(OC)c1ccccc1.
What is the InChIKey of 2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine?
The InChIKey is XOLXDPXEVBEWMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-12-9-10-15(19-2)14(11-12)16(18)17(20-3)13-7-5-4-6-8-13/h4-11,16-17H,18H2,1-3H3.
What are the key properties of 2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine?
2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine has a molecular weight of 271.36 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine is sourced from PubChem (CID 116772779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).