2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine

C14H24N2O2 — CID 43268159

IUPAC2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine
SMILESCCN(CC)CCOc1ccc(OC)cc1CN
InChIInChI=1S/C14H24N2O2/c1-4-16(5-2)8-9-18-14-7-6-13(17-3)10-12(14)11-15/h6-7,10H,4-5,8-9,11,15H2,1-3H3
InChIKeyPXMHSIAHPTWUQR-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.87
Rot. Bonds8

About 2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine

2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine (PubChem CID 43268159) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine.

Molecular Properties

Compound Name2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine
PubChem CID43268159
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine
SMILESCCN(CC)CCOc1ccc(OC)cc1CN
InChIInChI=1S/C14H24N2O2/c1-4-16(5-2)8-9-18-14-7-6-13(17-3)10-12(14)11-15/h6-7,10H,4-5,8-9,11,15H2,1-3H3
InChIKeyPXMHSIAHPTWUQR-UHFFFAOYSA-N
XLogP1.87
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[2-(diethylamino)ethoxy]-5-methoxyphenyl]methanol
CID 43267964
2-[2-(aminomethyl)phenoxy]-N,N-diethylethanamine
CID 16787209
1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]ethanone
CID 82002145
[5-methoxy-2-(2-pyrrolidin-1-ylethoxy)phenyl]methanamine
CID 60879649
[5-methoxy-2-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]methanamine
CID 82889010
[5-methoxy-2-[3-(2,2,2-trifluoroethoxy)propoxy]phenyl]methanamine
CID 61490995
[5-methoxy-2-(pyrimidin-2-ylmethoxy)phenyl]methanamine
CID 62697998
1-[2-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-N-ethylethanamine
CID 82000221
[2-(cyclopropylmethoxymethoxy)-5-methoxyphenyl]methanamine
CID 106929092
3-[2-(aminomethyl)-4-methoxyphenoxy]propane-1,2-diol
CID 82843216
N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine
CID 63696644
3-[2-(diethylamino)ethoxy]-5-methoxyaniline
CID 80748413

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine?
The IUPAC name of 2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine (CID 43268159) is 2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine.
What is the SMILES notation for 2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine?
The canonical SMILES for 2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine is CCN(CC)CCOc1ccc(OC)cc1CN.
What is the InChIKey of 2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine?
The InChIKey is PXMHSIAHPTWUQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-4-16(5-2)8-9-18-14-7-6-13(17-3)10-12(14)11-15/h6-7,10H,4-5,8-9,11,15H2,1-3H3.
What are the key properties of 2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine?
2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine has a molecular weight of 252.36 g/mol, XLogP of 1.87, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)-4-methoxyphenoxy]-N,N-diethylethanamine is sourced from PubChem (CID 43268159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).