1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine

C17H30N2O2 — CID 82000221

IUPAC1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine
SMILESCCNC(C)c1ccc(OC)cc1OCCN(CC)CC
InChIInChI=1S/C17H30N2O2/c1-6-18-14(4)16-10-9-15(20-5)13-17(16)21-12-11-19(7-2)8-3/h9-10,13-14,18H,6-8,11-12H2,1-5H3
InChIKeyOWFZSBXSWZQZTO-UHFFFAOYSA-N
MW294.44 g/mol
LogP3.09
Rot. Bonds10

About 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine

1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine (PubChem CID 82000221) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine.

Molecular Properties

Compound Name1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine
PubChem CID82000221
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine
SMILESCCNC(C)c1ccc(OC)cc1OCCN(CC)CC
InChIInChI=1S/C17H30N2O2/c1-6-18-14(4)16-10-9-15(20-5)13-17(16)21-12-11-19(7-2)8-3/h9-10,13-14,18H,6-8,11-12H2,1-5H3
InChIKeyOWFZSBXSWZQZTO-UHFFFAOYSA-N
XLogP3.09
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-[1-(ethylamino)ethyl]-5-methoxyphenoxy]-2-methylbutan-2-ol
CID 82000365
3-[2-[1-(ethylamino)ethyl]-5-methoxyphenoxy]propane-1,2-diol
CID 82850774
4-[5-methoxy-2-[1-(propylamino)ethyl]phenoxy]butan-1-ol
CID 82000949
1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone
CID 82002145
N-ethyl-1-[4-methoxy-2-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine
CID 82000944
[2-[2-(diethylamino)ethoxy]-5-methoxyphenyl]methanol
CID 43267964
2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine
CID 43268159
1-(4-bromo-2-butoxyphenyl)-N-ethylethanamine
CID 82976092
2-[5-methoxy-2-[1-(propylamino)ethyl]phenoxy]-N,N-dimethylacetamide
CID 82000377
1-[4-bromo-2-(2-methoxyethoxy)phenyl]-N-ethylethanamine
CID 82976363
1-[2-(2,4-dimethoxyphenyl)phenyl]-N-ethylethanamine
CID 61033910
2-[5-methoxy-2-[1-(propylamino)ethyl]phenoxy]-N-methylacetamide
CID 82000648

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine?
The IUPAC name of 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine (CID 82000221) is 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine.
What is the SMILES notation for 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine?
The canonical SMILES for 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine is CCNC(C)c1ccc(OC)cc1OCCN(CC)CC.
What is the InChIKey of 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine?
The InChIKey is OWFZSBXSWZQZTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-6-18-14(4)16-10-9-15(20-5)13-17(16)21-12-11-19(7-2)8-3/h9-10,13-14,18H,6-8,11-12H2,1-5H3.
What are the key properties of 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine?
1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine has a molecular weight of 294.44 g/mol, XLogP of 3.09, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine is sourced from PubChem (CID 82000221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).