N-methoxy-1-(4-methoxyphenyl)ethanamine

C10H15NO2 — CID 82706779

IUPACN-methoxy-1-(4-methoxyphenyl)ethanamine
SMILESCONC(C)c1ccc(OC)cc1
InChIInChI=1S/C10H15NO2/c1-8(11-13-3)9-4-6-10(12-2)7-5-9/h4-8,11H,1-3H3
InChIKeyYIHUHFRNIISUSB-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.91
Rot. Bonds4

About N-methoxy-1-(4-methoxyphenyl)ethanamine

N-methoxy-1-(4-methoxyphenyl)ethanamine (PubChem CID 82706779) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is N-methoxy-1-(4-methoxyphenyl)ethanamine.

Molecular Properties

Compound NameN-methoxy-1-(4-methoxyphenyl)ethanamine
PubChem CID82706779
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC NameN-methoxy-1-(4-methoxyphenyl)ethanamine
SMILESCONC(C)c1ccc(OC)cc1
InChIInChI=1S/C10H15NO2/c1-8(11-13-3)9-4-6-10(12-2)7-5-9/h4-8,11H,1-3H3
InChIKeyYIHUHFRNIISUSB-UHFFFAOYSA-N
XLogP1.91
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(4-methoxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]ethanamine
CID 12644064
(1S)-1-(4-methoxyphenyl)-N-propan-2-yloxyethanamine
CID 163358815
ethane;1-(4-methoxyphenyl)-N-methylethanamine
CID 143114257
N-[(1R)-1-(4-methoxyphenyl)ethyl]-2-methylpropan-2-amine
CID 58628220
1-(4-ethylphenyl)-N-methoxyethanamine
CID 82706514
N-methoxy-1-(4-phenylmethoxyphenyl)ethanamine
CID 82707269
N-[(1S)-1-(4-methoxyphenyl)ethyl]methanethioamide
CID 131162335
ethane;N-ethyl-1-(4-methoxyphenyl)ethanamine
CID 143132018
N-[1-(4-methoxyphenyl)ethyl]formamide
CID 3115584
N-[1-(4-tert-butylphenyl)ethyl]-4-methoxyaniline
CID 10379104
N-[(1S)-1-(4-methoxyphenyl)ethyl]methanesulfonamide
CID 81363887
3-methoxy-N-[1-(4-methoxyphenyl)ethyl]butan-2-amine
CID 113260762

Frequently Asked Questions

What is the IUPAC name of N-methoxy-1-(4-methoxyphenyl)ethanamine?
The IUPAC name of N-methoxy-1-(4-methoxyphenyl)ethanamine (CID 82706779) is N-methoxy-1-(4-methoxyphenyl)ethanamine.
What is the SMILES notation for N-methoxy-1-(4-methoxyphenyl)ethanamine?
The canonical SMILES for N-methoxy-1-(4-methoxyphenyl)ethanamine is CONC(C)c1ccc(OC)cc1.
What is the InChIKey of N-methoxy-1-(4-methoxyphenyl)ethanamine?
The InChIKey is YIHUHFRNIISUSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-8(11-13-3)9-4-6-10(12-2)7-5-9/h4-8,11H,1-3H3.
What are the key properties of N-methoxy-1-(4-methoxyphenyl)ethanamine?
N-methoxy-1-(4-methoxyphenyl)ethanamine has a molecular weight of 181.23 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-1-(4-methoxyphenyl)ethanamine is sourced from PubChem (CID 82706779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).