N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine

C16H25NO — CID 62038734

IUPACN-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine
SMILESCCNC(CC)COc1ccc2c(c1)CCCC2
InChIInChI=1S/C16H25NO/c1-3-15(17-4-2)12-18-16-10-9-13-7-5-6-8-14(13)11-16/h9-11,15,17H,3-8,12H2,1-2H3
InChIKeyGUTUBQGDEBVSOC-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.33
Rot. Bonds6

About N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine

N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine (PubChem CID 62038734) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine
PubChem CID62038734
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC NameN-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine
SMILESCCNC(CC)COc1ccc2c(c1)CCCC2
InChIInChI=1S/C16H25NO/c1-3-15(17-4-2)12-18-16-10-9-13-7-5-6-8-14(13)11-16/h9-11,15,17H,3-8,12H2,1-2H3
InChIKeyGUTUBQGDEBVSOC-UHFFFAOYSA-N
XLogP3.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dihydro-1H-inden-5-yloxy)-N-ethyl-3-methoxypropan-2-amine
CID 107506688
1-(2,3-dihydro-1H-inden-5-yloxy)-N-methylpentan-2-amine
CID 62043866
1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pentan-2-ol
CID 62042802
3-(2,3-dihydro-1H-inden-5-yloxy)-2-methyl-N-propan-2-ylpropan-1-amine
CID 62459279
N-ethyl-1-(4-fluorophenoxy)butan-2-amine
CID 62038922
1-(2,3-dihydro-1H-inden-5-yloxy)propan-2-ylhydrazine
CID 82283353
N-ethyl-4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-1-amine
CID 55075397
1-(2,3-dihydro-1H-inden-5-yloxy)pentan-2-ol
CID 62041508
1-cyclohexyl-N-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethanamine
CID 104749235
3-N,3-N-dimethyl-4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butane-1,3-diamine
CID 112501002
1-(3,5-difluorophenoxy)-N-ethylbutan-2-amine
CID 62785969
1-(2,3-dihydro-1H-inden-5-yl)-5-ethoxy-N-ethylpentan-2-amine
CID 105152368

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine?
The IUPAC name of N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine (CID 62038734) is N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine.
What is the SMILES notation for N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine?
The canonical SMILES for N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine is CCNC(CC)COc1ccc2c(c1)CCCC2.
What is the InChIKey of N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine?
The InChIKey is GUTUBQGDEBVSOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-3-15(17-4-2)12-18-16-10-9-13-7-5-6-8-14(13)11-16/h9-11,15,17H,3-8,12H2,1-2H3.
What are the key properties of N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine?
N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine has a molecular weight of 247.38 g/mol, XLogP of 3.33, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine is sourced from PubChem (CID 62038734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).