N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline

C18H24N2O — CID 3063866

IUPACN-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline
SMILESCc1ccccc1NCc1ccccc1OCCN(C)C
InChIInChI=1S/C18H24N2O/c1-15-8-4-6-10-17(15)19-14-16-9-5-7-11-18(16)21-13-12-20(2)3/h4-11,19H,12-14H2,1-3H3
InChIKeySBTJSPPXZNCVCV-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.55
Rot. Bonds7

About N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline

N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline (PubChem CID 3063866) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline.

Molecular Properties

Compound NameN-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline
PubChem CID3063866
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline
SMILESCc1ccccc1NCc1ccccc1OCCN(C)C
InChIInChI=1S/C18H24N2O/c1-15-8-4-6-10-17(15)19-14-16-9-5-7-11-18(16)21-13-12-20(2)3/h4-11,19H,12-14H2,1-3H3
InChIKeySBTJSPPXZNCVCV-UHFFFAOYSA-N
XLogP3.55
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 ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-2-[2-(methylaminomethyl)phenoxy]ethanamine
CID 18525858
3-[2-(dimethylamino)ethoxy]-N-[(2-methylphenyl)methyl]aniline
CID 43720831
N-[(2-hexoxyphenyl)methyl]-2,3-dimethylaniline
CID 54797773
6-[[2-[2-(dimethylamino)ethoxy]phenyl]methylamino]pyridine-2-carbonitrile
CID 133392284
1-tert-butyl-3-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylguanidine;hydroiodide
CID 110964844
N',N'-dimethyl-N-(2-methylphenyl)propane-1,3-diamine
CID 3021697
N-[[2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]-2-methylaniline
CID 126118021
2-[(2-methylanilino)methyl]phenol
CID 3240149
N-[(2-cyclopentyloxyphenyl)methyl]-2-methylaniline
CID 39381668
5-chloro-2-methyl-N-[(2-propoxyphenyl)methyl]aniline
CID 39394866
N-[[3-methoxy-2-(2-methoxyethoxy)phenyl]methyl]-2-methylaniline
CID 39425332
N-[(5-bromo-2-propoxyphenyl)methyl]-2-methylaniline
CID 43766070

Frequently Asked Questions

What is the IUPAC name of N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline?
The IUPAC name of N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline (CID 3063866) is N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline.
What is the SMILES notation for N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline?
The canonical SMILES for N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline is Cc1ccccc1NCc1ccccc1OCCN(C)C.
What is the InChIKey of N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline?
The InChIKey is SBTJSPPXZNCVCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-15-8-4-6-10-17(15)19-14-16-9-5-7-11-18(16)21-13-12-20(2)3/h4-11,19H,12-14H2,1-3H3.
What are the key properties of N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline?
N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline has a molecular weight of 284.40 g/mol, XLogP of 3.55, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methylaniline is sourced from PubChem (CID 3063866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).