2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine

C15H26N2O2 — CID 103952764

IUPAC2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine
SMILESCCOc1ccc(CNCCOCCN(C)C)cc1
InChIInChI=1S/C15H26N2O2/c1-4-19-15-7-5-14(6-8-15)13-16-9-11-18-12-10-17(2)3/h5-8,16H,4,9-13H2,1-3H3
InChIKeyOQFGXDMSRMUTCJ-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.75
Rot. Bonds10

About 2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine

2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine (PubChem CID 103952764) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine
PubChem CID103952764
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine
SMILESCCOc1ccc(CNCCOCCN(C)C)cc1
InChIInChI=1S/C15H26N2O2/c1-4-19-15-7-5-14(6-8-15)13-16-9-11-18-12-10-17(2)3/h5-8,16H,4,9-13H2,1-3H3
InChIKeyOQFGXDMSRMUTCJ-UHFFFAOYSA-N
XLogP1.75
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[4-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]phenyl]methanol
CID 114127511
N-[(4-ethoxyphenyl)methyl]-2-propan-2-yloxyethanamine
CID 104588362
1-(4-ethoxyphenyl)-N-[(4-ethoxyphenyl)methyl]methanamine;hydrochloride
CID 170995213
3-[(4-ethoxyphenyl)methylamino]propan-1-ol
CID 7991761
N-[(4-ethoxyphenyl)methyl]-3-fluoropropan-1-amine
CID 115733079
N-[(4-ethoxyphenyl)methyl]hexan-1-amine;hydrochloride
CID 17291090
2-butoxy-N-[(4-methoxyphenyl)methyl]ethanamine
CID 55137655
N-[(4-ethoxyphenyl)methyl]-3,3,3-trifluoropropan-1-amine
CID 55173586
N-[(4-ethoxyphenyl)methyl]-N'-propan-2-ylethane-1,2-diamine
CID 113405276
N-(bromomethyl)-1-(4-ethoxyphenyl)methanamine
CID 115261867
2-ethoxy-N-[(4-ethylphenyl)methyl]ethanamine
CID 43590757
N-[[3-[2-[2-(dimethylamino)ethoxy]ethoxy]phenyl]methyl]propan-1-amine
CID 62458587

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine?
The IUPAC name of 2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine (CID 103952764) is 2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine.
What is the SMILES notation for 2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine?
The canonical SMILES for 2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine is CCOc1ccc(CNCCOCCN(C)C)cc1.
What is the InChIKey of 2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine?
The InChIKey is OQFGXDMSRMUTCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-4-19-15-7-5-14(6-8-15)13-16-9-11-18-12-10-17(2)3/h5-8,16H,4,9-13H2,1-3H3.
What are the key properties of 2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine?
2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine has a molecular weight of 266.38 g/mol, XLogP of 1.75, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethoxy]-N-[(4-ethoxyphenyl)methyl]ethanamine is sourced from PubChem (CID 103952764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).