7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol

C13H18O2 — CID 10954731

IUPAC7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCOc1cc(C)c2c(c1C)C(O)CCC2
InChIInChI=1S/C13H18O2/c1-8-7-12(15-3)9(2)13-10(8)5-4-6-11(13)14/h7,11,14H,4-6H2,1-3H3
InChIKeyZNXTXKFRQOHTES-UHFFFAOYSA-N
MW206.28 g/mol
LogP2.68
Rot. Bonds1

About 7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol

7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol (PubChem CID 10954731) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is 7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol
PubChem CID10954731
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCOc1cc(C)c2c(c1C)C(O)CCC2
InChIInChI=1S/C13H18O2/c1-8-7-12(15-3)9(2)13-10(8)5-4-6-11(13)14/h7,11,14H,4-6H2,1-3H3
InChIKeyZNXTXKFRQOHTES-UHFFFAOYSA-N
XLogP2.68
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The IUPAC name of 7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol (CID 10954731) is 7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The canonical SMILES for 7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol is COc1cc(C)c2c(c1C)C(O)CCC2.
What is the InChIKey of 7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The InChIKey is ZNXTXKFRQOHTES-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-8-7-12(15-3)9(2)13-10(8)5-4-6-11(13)14/h7,11,14H,4-6H2,1-3H3.
What are the key properties of 7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol?
7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol has a molecular weight of 206.28 g/mol, XLogP of 2.68, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 10954731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).