2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine

C17H23NO2 — CID 115655584

IUPAC2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine
SMILESCCOC(C)CNCc1ccc2cc(OC)ccc2c1
InChIInChI=1S/C17H23NO2/c1-4-20-13(2)11-18-12-14-5-6-16-10-17(19-3)8-7-15(16)9-14/h5-10,13,18H,4,11-12H2,1-3H3
InChIKeyQSMYIKHHHHIVDX-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.36
Rot. Bonds7

About 2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine

2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine (PubChem CID 115655584) has the molecular formula C17H23NO2 and a molecular weight of 273.38 g/mol. Its IUPAC name is 2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine.

Molecular Properties

Compound Name2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine
PubChem CID115655584
Molecular FormulaC17H23NO2
Molecular Weight273.38 g/mol
Exact Mass273.17
IUPAC Name2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine
SMILESCCOC(C)CNCc1ccc2cc(OC)ccc2c1
InChIInChI=1S/C17H23NO2/c1-4-20-13(2)11-18-12-14-5-6-16-10-17(19-3)8-7-15(16)9-14/h5-10,13,18H,4,11-12H2,1-3H3
InChIKeyQSMYIKHHHHIVDX-UHFFFAOYSA-N
XLogP3.36
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(6-methoxynaphthalen-2-yl)methyl]-2,3,3-trimethylbutan-1-amine
CID 83141221
2-cyclopropyl-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine
CID 115592755
2-ethoxy-N-[(2-methylquinolin-6-yl)methyl]propan-1-amine
CID 105378678
2-[(2-ethoxypropylamino)methyl]-5-methoxyphenol
CID 115655741
3-[(6-methoxynaphthalen-2-yl)methylamino]propane-1,2-diol
CID 66175454
2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine
CID 102911958
N-[(3,4-dibromophenyl)methyl]-2-ethoxypropan-1-amine
CID 115693242
N-[(3,4-dichlorophenyl)methyl]-2-ethoxypropan-1-amine
CID 115655535
2-ethoxy-N-[(4-propoxyphenyl)methyl]propan-1-amine
CID 115655586
2-ethoxy-N-[(3-ethoxyphenyl)methyl]propan-1-amine
CID 115655619
N-[(4-bromo-3-methylphenyl)methyl]-2-ethoxypropan-1-amine
CID 115668244
N-[(6-methoxynaphthalen-2-yl)methyl]-1-phenylmethanamine
CID 18505307

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine?
The IUPAC name of 2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine (CID 115655584) is 2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine.
What is the SMILES notation for 2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine?
The canonical SMILES for 2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine is CCOC(C)CNCc1ccc2cc(OC)ccc2c1.
What is the InChIKey of 2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine?
The InChIKey is QSMYIKHHHHIVDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO2/c1-4-20-13(2)11-18-12-14-5-6-16-10-17(19-3)8-7-15(16)9-14/h5-10,13,18H,4,11-12H2,1-3H3.
What are the key properties of 2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine?
2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine has a molecular weight of 273.38 g/mol, XLogP of 3.36, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine is sourced from PubChem (CID 115655584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).