ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol

C16H22O2 — CID 143419787

IUPACethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol
SMILESCC.COc1ccc2cc(O)c(C(C)C)cc2c1
InChIInChI=1S/C14H16O2.C2H6/c1-9(2)13-7-11-6-12(16-3)5-4-10(11)8-14(13)15;1-2/h4-9,15H,1-3H3;1-2H3
InChIKeySVOSLFUWBONLBI-UHFFFAOYSA-N
MW246.35 g/mol
LogP4.70
Rot. Bonds2

About ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol

ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol (PubChem CID 143419787) has the molecular formula C16H22O2 and a molecular weight of 246.35 g/mol. Its IUPAC name is ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol.

Molecular Properties

Compound Nameethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol
PubChem CID143419787
Molecular FormulaC16H22O2
Molecular Weight246.35 g/mol
Exact Mass246.16
IUPAC Nameethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol
SMILESCC.COc1ccc2cc(O)c(C(C)C)cc2c1
InChIInChI=1S/C14H16O2.C2H6/c1-9(2)13-7-11-6-12(16-3)5-4-10(11)8-14(13)15;1-2/h4-9,15H,1-3H3;1-2H3
InChIKeySVOSLFUWBONLBI-UHFFFAOYSA-N
XLogP4.70
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol?
The IUPAC name of ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol (CID 143419787) is ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol.
What is the SMILES notation for ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol?
The canonical SMILES for ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol is CC.COc1ccc2cc(O)c(C(C)C)cc2c1.
What is the InChIKey of ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol?
The InChIKey is SVOSLFUWBONLBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O2.C2H6/c1-9(2)13-7-11-6-12(16-3)5-4-10(11)8-14(13)15;1-2/h4-9,15H,1-3H3;1-2H3.
What are the key properties of ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol?
ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol has a molecular weight of 246.35 g/mol, XLogP of 4.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol is sourced from PubChem (CID 143419787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).