7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol

C23H25NO3 — CID 173058902

IUPAC7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol
SMILESCCOc1ccc(OC2CCNCC2c2ccc3cccc(O)c3c2)cc1
InChIInChI=1S/C23H25NO3/c1-2-26-18-8-10-19(11-9-18)27-23-12-13-24-15-21(23)17-7-6-16-4-3-5-22(25)20(16)14-17/h3-11,14,21,23-25H,2,12-13,15H2,1H3
InChIKeyYPVGNFOSJPWUFA-UHFFFAOYSA-N
MW363.46 g/mol
LogP4.47
Rot. Bonds5

About 7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol

7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol (PubChem CID 173058902) has the molecular formula C23H25NO3 and a molecular weight of 363.46 g/mol. Its IUPAC name is 7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol.

Molecular Properties

Compound Name7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol
PubChem CID173058902
Molecular FormulaC23H25NO3
Molecular Weight363.46 g/mol
Exact Mass363.18
IUPAC Name7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol
SMILESCCOc1ccc(OC2CCNCC2c2ccc3cccc(O)c3c2)cc1
InChIInChI=1S/C23H25NO3/c1-2-26-18-8-10-19(11-9-18)27-23-12-13-24-15-21(23)17-7-6-16-4-3-5-22(25)20(16)14-17/h3-11,14,21,23-25H,2,12-13,15H2,1H3
InChIKeyYPVGNFOSJPWUFA-UHFFFAOYSA-N
XLogP4.47
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol?
The IUPAC name of 7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol (CID 173058902) is 7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol.
What is the SMILES notation for 7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol?
The canonical SMILES for 7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol is CCOc1ccc(OC2CCNCC2c2ccc3cccc(O)c3c2)cc1.
What is the InChIKey of 7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol?
The InChIKey is YPVGNFOSJPWUFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO3/c1-2-26-18-8-10-19(11-9-18)27-23-12-13-24-15-21(23)17-7-6-16-4-3-5-22(25)20(16)14-17/h3-11,14,21,23-25H,2,12-13,15H2,1H3.
What are the key properties of 7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol?
7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol has a molecular weight of 363.46 g/mol, XLogP of 4.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol is sourced from PubChem (CID 173058902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).