N-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine

C14H23NO3 — CID 115259613

IUPACN-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine
SMILESCCN(C)CCc1c(OC)cc(OC)cc1OC
InChIInChI=1S/C14H23NO3/c1-6-15(2)8-7-12-13(17-4)9-11(16-3)10-14(12)18-5/h9-10H,6-8H2,1-5H3
InChIKeyUTOKBPKIUNXRKK-UHFFFAOYSA-N
MW253.34 g/mol
LogP2.21
Rot. Bonds7

About N-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine

N-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine (PubChem CID 115259613) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine
PubChem CID115259613
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC NameN-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine
SMILESCCN(C)CCc1c(OC)cc(OC)cc1OC
InChIInChI=1S/C14H23NO3/c1-6-15(2)8-7-12-13(17-4)9-11(16-3)10-14(12)18-5/h9-10H,6-8H2,1-5H3
InChIKeyUTOKBPKIUNXRKK-UHFFFAOYSA-N
XLogP2.21
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N'-methyl-N'-[(2,4,6-trimethoxyphenyl)methyl]ethane-1,2-diamine
CID 55103553
2-(3,4-dimethoxyphenyl)-N-ethyl-N-methylethanamine
CID 18789952
2-[2-[ethyl(methyl)amino]ethyl]-4,5-dimethoxyaniline;hydrochloride
CID 18789881
3-[methyl-[(2,4,6-trimethoxyphenyl)methyl]amino]propanenitrile
CID 115231000
N-methyl-3-(2,4,6-trimethoxyphenyl)propanehydrazide
CID 116844991
N-methyl-3-phenyl-N-[(2,4,6-trimethoxyphenyl)methyl]propan-1-amine
CID 146255660
2-(iodomethyl)-1,3,5-trimethoxybenzene
CID 10946751
2-[(2,4-dimethoxy-6-methylphenyl)methyl-methylamino]ethanethiol
CID 115224150
2-(5-bromopentyl)-1,3,5-trimethoxybenzene
CID 56956628
3,5-dimethoxy-2-propylaniline
CID 141261453
methyl 3-(2,4,6-trimethoxyphenyl)propanoate
CID 25107739
N-ethyl-2-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-methylethanamine
CID 59921071

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine?
The IUPAC name of N-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine (CID 115259613) is N-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine.
What is the SMILES notation for N-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine?
The canonical SMILES for N-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine is CCN(C)CCc1c(OC)cc(OC)cc1OC.
What is the InChIKey of N-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine?
The InChIKey is UTOKBPKIUNXRKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-6-15(2)8-7-12-13(17-4)9-11(16-3)10-14(12)18-5/h9-10H,6-8H2,1-5H3.
What are the key properties of N-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine?
N-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine has a molecular weight of 253.34 g/mol, XLogP of 2.21, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-(2,4,6-trimethoxyphenyl)ethanamine is sourced from PubChem (CID 115259613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).