2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol

C14H20O — CID 10856608

IUPAC2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCCCCC1CCc2ccccc2C1O
InChIInChI=1S/C14H20O/c1-2-3-6-12-10-9-11-7-4-5-8-13(11)14(12)15/h4-5,7-8,12,14-15H,2-3,6,9-10H2,1H3
InChIKeyLXOKJQILKQSATL-UHFFFAOYSA-N
MW204.31 g/mol
LogP3.47
Rot. Bonds3

About 2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol

2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol (PubChem CID 10856608) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol
PubChem CID10856608
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCCCCC1CCc2ccccc2C1O
InChIInChI=1S/C14H20O/c1-2-3-6-12-10-9-11-7-4-5-8-13(11)14(12)15/h4-5,7-8,12,14-15H,2-3,6,9-10H2,1H3
InChIKeyLXOKJQILKQSATL-UHFFFAOYSA-N
XLogP3.47
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-hexyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 63460691
ethane;2-ethyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 145337942
2-(2-propylsulfonylethyl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 106729008
2-(hydroxymethyl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 12522311
(1R,2S)-2-[(dimethylamino)methyl]-1,2,3,4-tetrahydronaphthalen-1-ol
CID 70291111
6-(3-fluoropropyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ol
CID 81114397
2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1,2,3,4-tetrahydronaphthalen-1-ol
CID 104565816
6-(2-hydroxyethyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ol
CID 79422801
(1S,2S)-2-[(E)-but-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-ol
CID 101152494
1-bromo-2-(2-butoxyethyl)-1,2,3,4-tetrahydronaphthalene
CID 55192835
2-(2-pyridin-2-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 79423311
6-butyl-N-ethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 63403512

Frequently Asked Questions

What is the IUPAC name of 2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The IUPAC name of 2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol (CID 10856608) is 2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The canonical SMILES for 2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol is CCCCC1CCc2ccccc2C1O.
What is the InChIKey of 2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The InChIKey is LXOKJQILKQSATL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-2-3-6-12-10-9-11-7-4-5-8-13(11)14(12)15/h4-5,7-8,12,14-15H,2-3,6,9-10H2,1H3.
What are the key properties of 2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol?
2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol has a molecular weight of 204.31 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-1,2,3,4-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 10856608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).