8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol

C16H25NO — CID 18366451

IUPAC8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESCCCN(CCC)C1CCCc2cccc(O)c21
InChIInChI=1S/C16H25NO/c1-3-11-17(12-4-2)14-9-5-7-13-8-6-10-15(18)16(13)14/h6,8,10,14,18H,3-5,7,9,11-12H2,1-2H3
InChIKeyCPXKXLSFUJLYFN-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.89
Rot. Bonds5

About 8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol

8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol (PubChem CID 18366451) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol
PubChem CID18366451
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESCCCN(CCC)C1CCCc2cccc(O)c21
InChIInChI=1S/C16H25NO/c1-3-11-17(12-4-2)14-9-5-7-13-8-6-10-15(18)16(13)14/h6,8,10,14,18H,3-5,7,9,11-12H2,1-2H3
InChIKeyCPXKXLSFUJLYFN-UHFFFAOYSA-N
XLogP3.89
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

(7R,8R)-7-(dipropylamino)-8-methyl-5,6,7,8-tetrahydronaphthalen-1-ol;hydrochloride
CID 73349829
8-(ethylamino)-5,6,7,8-tetrahydronaphthalen-1-ol
CID 105445416
2-[propyl(1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetic acid
CID 65064550
(7R)-7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol
CID 6603866
(8R)-8-amino-5,6,7,8-tetrahydronaphthalen-1-ol
CID 130673743
8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol
CID 83827745
(3R)-N-benzyl-3-(dipropylamino)-2,3-dihydro-1H-indene-4-carboxamide
CID 10594038
2-(dipropylamino)cyclopentan-1-one
CID 43794618
8-(1-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol
CID 105445428
2-(8-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)acetaldehyde
CID 112546950
(6S)-6-[7-[[(2S)-5-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]-propylamino]heptyl-propylamino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 71459664
6-N-ethyl-6-N-propyl-6,7,8,9-tetrahydro-5H-benzo[7]annulene-5,6-diamine
CID 43268680

Frequently Asked Questions

What is the IUPAC name of 8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol?
The IUPAC name of 8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol (CID 18366451) is 8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol?
The canonical SMILES for 8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol is CCCN(CCC)C1CCCc2cccc(O)c21.
What is the InChIKey of 8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol?
The InChIKey is CPXKXLSFUJLYFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-3-11-17(12-4-2)14-9-5-7-13-8-6-10-15(18)16(13)14/h6,8,10,14,18H,3-5,7,9,11-12H2,1-2H3.
What are the key properties of 8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol?
8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol has a molecular weight of 247.38 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 18366451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).