1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine

C12H19NO2 — CID 166879761

IUPAC1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine
SMILESCOCCOc1ccc(CN(C)C)cc1
InChIInChI=1S/C12H19NO2/c1-13(2)10-11-4-6-12(7-5-11)15-9-8-14-3/h4-7H,8-10H2,1-3H3
InChIKeySWOJFBZRPSCFMG-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.77
Rot. Bonds6

About 1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine

1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine (PubChem CID 166879761) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine
PubChem CID166879761
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine
SMILESCOCCOc1ccc(CN(C)C)cc1
InChIInChI=1S/C12H19NO2/c1-13(2)10-11-4-6-12(7-5-11)15-9-8-14-3/h4-7H,8-10H2,1-3H3
InChIKeySWOJFBZRPSCFMG-UHFFFAOYSA-N
XLogP1.77
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2-methoxyethoxy)-4-(3-methylbutyl)benzene
CID 156727019
[4-[(dimethylamino)methyl]phenyl] acetate
CID 102268693
2-[4-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]phenyl]ethanamine
CID 152682360
2-[[4-(2-methoxyethoxy)phenyl]methyl]pyrimidine
CID 151551370
3-[4-(2-methoxyethoxy)phenyl]propanenitrile
CID 98014003
N,N-dimethyl-1-[4-[3-(4,5,6,7-tetramethoxy-2,3-dihydro-1H-inden-2-yl)propoxy]phenyl]methanamine
CID 18348595
1-(2-methoxyethoxy)-4-phenylbenzene
CID 20582782
trifluoro-[4-(2-methoxyethoxy)phenyl]boranuide
CID 63677654
[4-(2-methoxyethoxy)phenyl]-methylidyneazanium
CID 177451533
1-(2-methoxyethoxy)-4-methylsulfanyloxybenzene
CID 59702789
N,N-dimethyl-3-phenoxypropan-1-amine;N,N-dimethyl-1-phenylmethanamine;ethane
CID 166529218
N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine
CID 84775253

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine (CID 166879761) is 1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine is COCCOc1ccc(CN(C)C)cc1.
What is the InChIKey of 1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine?
The InChIKey is SWOJFBZRPSCFMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-13(2)10-11-4-6-12(7-5-11)15-9-8-14-3/h4-7H,8-10H2,1-3H3.
What are the key properties of 1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine?
1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine has a molecular weight of 209.29 g/mol, XLogP of 1.77, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine is sourced from PubChem (CID 166879761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).