3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline

C18H24N2O — CID 62484882

IUPAC3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline
SMILESCCNCc1ccccc1COc1cccc(N(C)C)c1
InChIInChI=1S/C18H24N2O/c1-4-19-13-15-8-5-6-9-16(15)14-21-18-11-7-10-17(12-18)20(2)3/h5-12,19H,4,13-14H2,1-3H3
InChIKeyLGTIWDNLPTVLAO-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.44
Rot. Bonds7

About 3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline

3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline (PubChem CID 62484882) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline.

Molecular Properties

Compound Name3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline
PubChem CID62484882
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline
SMILESCCNCc1ccccc1COc1cccc(N(C)C)c1
InChIInChI=1S/C18H24N2O/c1-4-19-13-15-8-5-6-9-16(15)14-21-18-11-7-10-17(12-18)20(2)3/h5-12,19H,4,13-14H2,1-3H3
InChIKeyLGTIWDNLPTVLAO-UHFFFAOYSA-N
XLogP3.44
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[4-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline
CID 62484357
3-[[2-(aminomethyl)phenyl]methoxy]-N,N-dimethylaniline
CID 22688623
N-[[2-[(3,4-dimethylphenoxy)methyl]phenyl]methyl]ethanamine
CID 62452521
N-[[2-[(3,4-dichlorophenoxy)methyl]phenyl]methyl]ethanamine
CID 63497555
3-[2-(ethylaminomethyl)-4-fluorophenoxy]-N,N-dimethylaniline
CID 61229881
N-[[3-[(2-chlorophenyl)methoxy]phenyl]methyl]ethanamine;hydrochloride
CID 17290789
N,N-dimethyl-3-[[5-(propylaminomethyl)furan-2-yl]methoxy]aniline
CID 62484354
5-[[3-(dimethylamino)phenoxy]methyl]-N-ethylpyridin-2-amine
CID 62187827
1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine
CID 62453866
3-[[3-(dimethylamino)phenoxy]methyl]-4-fluorobenzoic acid
CID 63075215
N-[[2-[(3-bromophenoxy)methyl]phenyl]methyl]-2-methylpropan-1-amine
CID 63498759
N-[[2-[[ethyl(methyl)amino]methyl]phenyl]methyl]ethanamine
CID 62417230

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline?
The IUPAC name of 3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline (CID 62484882) is 3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline.
What is the SMILES notation for 3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline?
The canonical SMILES for 3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline is CCNCc1ccccc1COc1cccc(N(C)C)c1.
What is the InChIKey of 3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline?
The InChIKey is LGTIWDNLPTVLAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-4-19-13-15-8-5-6-9-16(15)14-21-18-11-7-10-17(12-18)20(2)3/h5-12,19H,4,13-14H2,1-3H3.
What are the key properties of 3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline?
3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline has a molecular weight of 284.40 g/mol, XLogP of 3.44, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(ethylaminomethyl)phenyl]methoxy]-N,N-dimethylaniline is sourced from PubChem (CID 62484882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).