2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline

C17H21NO2 — CID 43757835

IUPAC2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline
SMILESCOc1ccccc1NC(C)c1ccc(C)cc1OC
InChIInChI=1S/C17H21NO2/c1-12-9-10-14(17(11-12)20-4)13(2)18-15-7-5-6-8-16(15)19-3/h5-11,13,18H,1-4H3
InChIKeyUTMRSSJSODJAJS-UHFFFAOYSA-N
MW271.36 g/mol
LogP4.19
Rot. Bonds5

About 2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline

2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline (PubChem CID 43757835) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline.

Molecular Properties

Compound Name2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline
PubChem CID43757835
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline
SMILESCOc1ccccc1NC(C)c1ccc(C)cc1OC
InChIInChI=1S/C17H21NO2/c1-12-9-10-14(17(11-12)20-4)13(2)18-15-7-5-6-8-16(15)19-3/h5-11,13,18H,1-4H3
InChIKeyUTMRSSJSODJAJS-UHFFFAOYSA-N
XLogP4.19
TPSA30.49 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 ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-methoxy-4-methylphenyl)ethyl]-2-methylaniline
CID 43766137
2,3-dichloro-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline
CID 43772205
N-[1-(2-methoxy-4-methylphenyl)ethyl]-2-nitroaniline
CID 43785497
2-bromo-N-[1-(2-methoxy-4-methylphenyl)ethyl]-4-methylaniline
CID 43757713
2-methoxy-N-[1-(2-methylphenyl)ethyl]aniline
CID 43191325
2,4,5-trichloro-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline
CID 43759088
N-[1-(2-methoxy-4-methylphenyl)ethyl]-3-methylaniline
CID 43755641
2-bromo-4-fluoro-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline
CID 43772548
2,5-dichloro-N-[1-(2-methoxy-4-methylphenyl)ethyl]-4-methylaniline
CID 104726578
2-chloro-N-[1-(2-methoxy-5-methylphenyl)ethyl]aniline
CID 43106627
2-(difluoromethoxy)-N-[1-(2,4-dimethylphenyl)ethyl]aniline
CID 43096414
N-[1-(2-methoxy-4-methylphenyl)ethyl]-3-methylbutan-2-amine
CID 43773913

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline?
The IUPAC name of 2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline (CID 43757835) is 2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline.
What is the SMILES notation for 2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline?
The canonical SMILES for 2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline is COc1ccccc1NC(C)c1ccc(C)cc1OC.
What is the InChIKey of 2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline?
The InChIKey is UTMRSSJSODJAJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-12-9-10-14(17(11-12)20-4)13(2)18-15-7-5-6-8-16(15)19-3/h5-11,13,18H,1-4H3.
What are the key properties of 2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline?
2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline has a molecular weight of 271.36 g/mol, XLogP of 4.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline is sourced from PubChem (CID 43757835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).