7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol

C13H18O2 — CID 62738038

IUPAC7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCC(C)Oc1ccc2c(c1)C(O)CCC2
InChIInChI=1S/C13H18O2/c1-9(2)15-11-7-6-10-4-3-5-13(14)12(10)8-11/h6-9,13-14H,3-5H2,1-2H3
InChIKeyHLTQZBOYDYKIRP-UHFFFAOYSA-N
MW206.28 g/mol
LogP2.84
Rot. Bonds2

About 7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol

7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol (PubChem CID 62738038) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is 7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol
PubChem CID62738038
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCC(C)Oc1ccc2c(c1)C(O)CCC2
InChIInChI=1S/C13H18O2/c1-9(2)15-11-7-6-10-4-3-5-13(14)12(10)8-11/h6-9,13-14H,3-5H2,1-2H3
InChIKeyHLTQZBOYDYKIRP-UHFFFAOYSA-N
XLogP2.84
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-propan-2-yloxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ol
CID 62738037
7-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 114091344
3-[(8-hydroxy-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]propane-1,2-diol
CID 114091354
(1S)-7-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 79014448
7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 89110450
(1S)-7-(cyclopropylmethoxymethoxy)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 114091372
7-amino-1,2,3,4-tetrahydronaphthalen-1-ol
CID 15840809
6-propan-2-yloxy-1,2,3,4-tetrahydronaphthalene-1-carbonitrile
CID 83821545
7-[(4-phenylphenyl)methoxy]-1,2,3,4-tetrahydronaphthalen-1-ol
CID 166633236
7-methylsulfonyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 175738988
[(3R)-3-hydroxy-2,3-dihydro-1H-inden-5-yl] N-ethyl-N-methylcarbamate
CID 68829372
8-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carbonitrile
CID 57278272

Frequently Asked Questions

What is the IUPAC name of 7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol?
The IUPAC name of 7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol (CID 62738038) is 7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol?
The canonical SMILES for 7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol is CC(C)Oc1ccc2c(c1)C(O)CCC2.
What is the InChIKey of 7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol?
The InChIKey is HLTQZBOYDYKIRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-9(2)15-11-7-6-10-4-3-5-13(14)12(10)8-11/h6-9,13-14H,3-5H2,1-2H3.
What are the key properties of 7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol?
7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol has a molecular weight of 206.28 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-propan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 62738038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).