2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol

C14H20O2 — CID 84685964

IUPAC2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol
SMILESCOc1ccc(C(C)(C)O)c2c1CCCC2
InChIInChI=1S/C14H20O2/c1-14(2,15)12-8-9-13(16-3)11-7-5-4-6-10(11)12/h8-9,15H,4-7H2,1-3H3
InChIKeyUWGPGLXYQKVZQH-UHFFFAOYSA-N
MW220.31 g/mol
LogP2.80
Rot. Bonds2

About 2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol

2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol (PubChem CID 84685964) has the molecular formula C14H20O2 and a molecular weight of 220.31 g/mol. Its IUPAC name is 2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol.

Molecular Properties

Compound Name2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol
PubChem CID84685964
Molecular FormulaC14H20O2
Molecular Weight220.31 g/mol
Exact Mass220.15
IUPAC Name2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol
SMILESCOc1ccc(C(C)(C)O)c2c1CCCC2
InChIInChI=1S/C14H20O2/c1-14(2,15)12-8-9-13(16-3)11-7-5-4-6-10(11)12/h8-9,15H,4-7H2,1-3H3
InChIKeyUWGPGLXYQKVZQH-UHFFFAOYSA-N
XLogP2.80
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol?
The IUPAC name of 2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol (CID 84685964) is 2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol.
What is the SMILES notation for 2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol?
The canonical SMILES for 2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol is COc1ccc(C(C)(C)O)c2c1CCCC2.
What is the InChIKey of 2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol?
The InChIKey is UWGPGLXYQKVZQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O2/c1-14(2,15)12-8-9-13(16-3)11-7-5-4-6-10(11)12/h8-9,15H,4-7H2,1-3H3.
What are the key properties of 2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol?
2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol has a molecular weight of 220.31 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-2-ol is sourced from PubChem (CID 84685964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).