4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol

C24H27NO2 — CID 70081124

IUPAC4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol
SMILESOc1cc(Cc2ccccc2)c2cc(OCCN3CCCCC3)ccc2c1
InChIInChI=1S/C24H27NO2/c26-22-16-20-9-10-23(27-14-13-25-11-5-2-6-12-25)18-24(20)21(17-22)15-19-7-3-1-4-8-19/h1,3-4,7-10,16-18,26H,2,5-6,11-15H2
InChIKeyREUWHZKNJPDJIF-UHFFFAOYSA-N
MW361.49 g/mol
LogP5.00
Rot. Bonds6

About 4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol

4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol (PubChem CID 70081124) has the molecular formula C24H27NO2 and a molecular weight of 361.49 g/mol. Its IUPAC name is 4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol.

Molecular Properties

Compound Name4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol
PubChem CID70081124
Molecular FormulaC24H27NO2
Molecular Weight361.49 g/mol
Exact Mass361.20
IUPAC Name4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol
SMILESOc1cc(Cc2ccccc2)c2cc(OCCN3CCCCC3)ccc2c1
InChIInChI=1S/C24H27NO2/c26-22-16-20-9-10-23(27-14-13-25-11-5-2-6-12-25)18-24(20)21(17-22)15-19-7-3-1-4-8-19/h1,3-4,7-10,16-18,26H,2,5-6,11-15H2
InChIKeyREUWHZKNJPDJIF-UHFFFAOYSA-N
XLogP5.00
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.49
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-phenyl-5-[4-(2-piperidin-1-ylethoxy)phenoxy]naphthalen-2-ol
CID 10296965
2-[1-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]naphthalen-2-yl]oxyethanol
CID 57388624
1-[2-(4-phenylphenoxy)ethyl]piperidine
CID 58483683
6-(2-fluorophenyl)-5-[4-(2-piperidin-1-ylethoxy)phenoxy]naphthalen-2-ol;hydrochloride
CID 67005014
1-[2-[4-(3-methyl-1-phenylbutan-2-yl)phenoxy]ethyl]piperidine
CID 173305671
1-[2-(3-phenylphenoxy)ethyl]piperidine
CID 58483782
5-[(E)-2-(4-hydroxyphenyl)-2-[4-(2-piperidin-1-ylethoxy)phenyl]ethenyl]naphthalen-2-ol
CID 11454084
6-(3-hydroxy-4-methylphenyl)-5-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]naphthalen-2-ol
CID 18182697
1-[2-(2-naphthalen-2-yloxyethoxy)ethyl]pyrrolidine
CID 2246231
4-(4-hydroxyphenyl)-3-phenyl-7-(2-piperidin-1-ylethoxy)chromen-2-one
CID 71818110
1-[2-[4-[(Z)-1,2-diphenylpent-2-en-3-yl]phenoxy]ethyl]piperidine
CID 10296016
3-[2-(azocan-1-yl)ethoxy]benzoic acid
CID 43532593

Frequently Asked Questions

What is the IUPAC name of 4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol?
The IUPAC name of 4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol (CID 70081124) is 4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol.
What is the SMILES notation for 4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol?
The canonical SMILES for 4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol is Oc1cc(Cc2ccccc2)c2cc(OCCN3CCCCC3)ccc2c1.
What is the InChIKey of 4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol?
The InChIKey is REUWHZKNJPDJIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27NO2/c26-22-16-20-9-10-23(27-14-13-25-11-5-2-6-12-25)18-24(20)21(17-22)15-19-7-3-1-4-8-19/h1,3-4,7-10,16-18,26H,2,5-6,11-15H2.
What are the key properties of 4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol?
4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol has a molecular weight of 361.49 g/mol, XLogP of 5.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-6-(2-piperidin-1-ylethoxy)naphthalen-2-ol is sourced from PubChem (CID 70081124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).