7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol

C16H24FNO2 — CID 91477099

IUPAC7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol
SMILESCCCN(CC(F)OC)C1CCc2ccc(O)cc2C1
InChIInChI=1S/C16H24FNO2/c1-3-8-18(11-16(17)20-2)14-6-4-12-5-7-15(19)10-13(12)9-14/h5,7,10,14,16,19H,3-4,6,8-9,11H2,1-2H3
InChIKeyNJMVQAOZLYJCCT-UHFFFAOYSA-N
MW281.37 g/mol
LogP2.90
Rot. Bonds6

About 7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol

7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol (PubChem CID 91477099) has the molecular formula C16H24FNO2 and a molecular weight of 281.37 g/mol. Its IUPAC name is 7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol.

Molecular Properties

Compound Name7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol
PubChem CID91477099
Molecular FormulaC16H24FNO2
Molecular Weight281.37 g/mol
Exact Mass281.18
IUPAC Name7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol
SMILESCCCN(CC(F)OC)C1CCc2ccc(O)cc2C1
InChIInChI=1S/C16H24FNO2/c1-3-8-18(11-16(17)20-2)14-6-4-12-5-7-15(19)10-13(12)9-14/h5,7,10,14,16,19H,3-4,6,8-9,11H2,1-2H3
InChIKeyNJMVQAOZLYJCCT-UHFFFAOYSA-N
XLogP2.90
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.37
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(7R)-7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-2-ol bromide
CID 51371143
7-[[(E)-3-iodoprop-2-enyl]-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 6305587
7-[1-hydroxypropan-2-yl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 91363725
7-[propyl(3-thiophen-2-ylpropyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 57225664
7-[ethyl(methyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 10512444
7-[ethyl-[(1-methoxypiperidin-4-yl)methyl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 142248622
(7S)-7-[4-(4-phenylpiperazin-1-yl)butyl-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol;trihydrochloride
CID 24755407
7-[2-[4-(2,3-dichlorophenyl)piperazin-1-yl]ethyl-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 10479465
7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine
CID 14798947
N-(7-ethoxy-1,2,3,4-tetrahydronaphthalen-2-yl)-2,2,2-trifluoro-N-propylacetamide;2,2,2-trifluoro-N-(7-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl)-N-propylacetamide
CID 161065922
6-chloro-N,N-dipropyl-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
CID 91826447
[4-[(7-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl)-propylamino]piperidin-1-yl]-morpholin-4-ylmethanone
CID 22649552

Frequently Asked Questions

What is the IUPAC name of 7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol?
The IUPAC name of 7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol (CID 91477099) is 7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol.
What is the SMILES notation for 7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol?
The canonical SMILES for 7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol is CCCN(CC(F)OC)C1CCc2ccc(O)cc2C1.
What is the InChIKey of 7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol?
The InChIKey is NJMVQAOZLYJCCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO2/c1-3-8-18(11-16(17)20-2)14-6-4-12-5-7-15(19)10-13(12)9-14/h5,7,10,14,16,19H,3-4,6,8-9,11H2,1-2H3.
What are the key properties of 7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol?
7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol has a molecular weight of 281.37 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol is sourced from PubChem (CID 91477099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).