2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine

C17H24N2O — CID 39290120

IUPAC2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine
SMILESCCNCc1c(OCCN(C)C)ccc2ccccc12
InChIInChI=1S/C17H24N2O/c1-4-18-13-16-15-8-6-5-7-14(15)9-10-17(16)20-12-11-19(2)3/h5-10,18H,4,11-13H2,1-3H3
InChIKeyRWXXDVBRCOYRAE-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.89
Rot. Bonds7

About 2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine

2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine (PubChem CID 39290120) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine
PubChem CID39290120
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine
SMILESCCNCc1c(OCCN(C)C)ccc2ccccc12
InChIInChI=1S/C17H24N2O/c1-4-18-13-16-15-8-6-5-7-14(15)9-10-17(16)20-12-11-19(2)3/h5-10,18H,4,11-13H2,1-3H3
InChIKeyRWXXDVBRCOYRAE-UHFFFAOYSA-N
XLogP2.89
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(2-phenylethoxy)naphthalen-1-yl]methyl]ethanamine
CID 54804704
2-[2-[1-(ethylaminomethyl)naphthalen-2-yl]oxyethoxy]ethanol
CID 61070673
N-[(2-pent-3-ynoxynaphthalen-1-yl)methyl]ethanamine
CID 104804665
N-[[2-(2-ethylbutoxy)naphthalen-1-yl]methyl]ethanamine
CID 82926082
N-[[2-(2-pyrrolidin-1-ylethoxy)naphthalen-1-yl]methyl]ethanamine
CID 39313180
2-[3-chloro-2-(ethylaminomethyl)phenoxy]-N,N-dimethylethanamine
CID 114318958
N-[(2-but-2-ynoxynaphthalen-1-yl)methyl]ethanamine
CID 62311911
N-[[2-[(4-methylphenyl)methoxy]naphthalen-1-yl]methyl]ethanamine
CID 17054851
2-[1-(ethylaminomethyl)naphthalen-2-yl]oxyacetamide;hydrochloride
CID 17053536
N',N'-dimethyl-N-[(2-phenylmethoxynaphthalen-1-yl)methyl]ethane-1,2-diamine;dihydrochloride
CID 17294780
N-[(2-butoxynaphthalen-1-yl)methyl]-N',N'-diethylethane-1,2-diamine
CID 54849521
N'-[(2-ethoxynaphthalen-1-yl)methyl]-N-ethylpropane-1,3-diamine;dihydrochloride
CID 17215613

Frequently Asked Questions

What is the IUPAC name of 2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine?
The IUPAC name of 2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine (CID 39290120) is 2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine.
What is the SMILES notation for 2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine?
The canonical SMILES for 2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine is CCNCc1c(OCCN(C)C)ccc2ccccc12.
What is the InChIKey of 2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine?
The InChIKey is RWXXDVBRCOYRAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-4-18-13-16-15-8-6-5-7-14(15)9-10-17(16)20-12-11-19(2)3/h5-10,18H,4,11-13H2,1-3H3.
What are the key properties of 2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine?
2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine has a molecular weight of 272.39 g/mol, XLogP of 2.89, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine is sourced from PubChem (CID 39290120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).