2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine

C18H25NO2 — CID 115664040

IUPAC2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine
SMILESCOc1ccc2cc(C(C)NCC(C)(C)OC)ccc2c1
InChIInChI=1S/C18H25NO2/c1-13(19-12-18(2,3)21-5)14-6-7-16-11-17(20-4)9-8-15(16)10-14/h6-11,13,19H,12H2,1-5H3
InChIKeyXESUWKKFRGNLBV-UHFFFAOYSA-N
MW287.40 g/mol
LogP3.92
Rot. Bonds6

About 2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine

2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine (PubChem CID 115664040) has the molecular formula C18H25NO2 and a molecular weight of 287.40 g/mol. Its IUPAC name is 2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine
PubChem CID115664040
Molecular FormulaC18H25NO2
Molecular Weight287.40 g/mol
Exact Mass287.19
IUPAC Name2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine
SMILESCOc1ccc2cc(C(C)NCC(C)(C)OC)ccc2c1
InChIInChI=1S/C18H25NO2/c1-13(19-12-18(2,3)21-5)14-6-7-16-11-17(20-4)9-8-15(16)10-14/h6-11,13,19H,12H2,1-5H3
InChIKeyXESUWKKFRGNLBV-UHFFFAOYSA-N
XLogP3.92
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.40
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N'-bis[1-(6-methoxynaphthalen-2-yl)ethyl]ethane-1,2-diamine
CID 23154308
N-ethyl-1-(6-methoxynaphthalen-2-yl)ethanamine
CID 24708514
N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine
CID 43190378
N-[1-(4-bromophenyl)ethyl]-2-methoxy-2-methylpropan-1-amine
CID 115664039
1-(6-methoxynaphthalen-2-yl)-N-(2-methylsulfanylethyl)ethanamine
CID 63982854
N-[1-(4-iodophenyl)ethyl]-2-methoxy-2-methylpropan-1-amine
CID 115728734
2-methoxy-N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]-2-methylpropan-1-amine
CID 115728707
4-[1-(6-methoxynaphthalen-2-yl)ethylamino]butan-1-ol
CID 106840515
N-[1-(4-methoxyphenyl)ethyl]-2-methyl-2-methylsulfanylpropan-1-amine
CID 113262472
2-[2-[1-(6-methoxynaphthalen-2-yl)ethylamino]ethoxy]ethanol
CID 43207599
3-[1-(4-methoxyphenyl)ethylamino]-2,2-dimethylpropanoic acid
CID 79623366
N-[1-(4-methoxyphenyl)ethyl]-2-methyl-2-methylsulfonylpropan-1-amine
CID 79559232

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine?
The IUPAC name of 2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine (CID 115664040) is 2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine.
What is the SMILES notation for 2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine?
The canonical SMILES for 2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine is COc1ccc2cc(C(C)NCC(C)(C)OC)ccc2c1.
What is the InChIKey of 2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine?
The InChIKey is XESUWKKFRGNLBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NO2/c1-13(19-12-18(2,3)21-5)14-6-7-16-11-17(20-4)9-8-15(16)10-14/h6-11,13,19H,12H2,1-5H3.
What are the key properties of 2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine?
2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine has a molecular weight of 287.40 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]-2-methylpropan-1-amine is sourced from PubChem (CID 115664040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).