1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol

C23H37NO2 — CID 70218131

IUPAC1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol
SMILESCCOc1ccccc1C1CCN(C2CCCCCCCCC2)CC1O
InChIInChI=1S/C23H37NO2/c1-2-26-23-15-11-10-14-21(23)20-16-17-24(18-22(20)25)19-12-8-6-4-3-5-7-9-13-19/h10-11,14-15,19-20,22,25H,2-9,12-13,16-18H2,1H3
InChIKeyNLTJDWFSXBRQGZ-UHFFFAOYSA-N
MW359.55 g/mol
LogP5.13
Rot. Bonds4

About 1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol

1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol (PubChem CID 70218131) has the molecular formula C23H37NO2 and a molecular weight of 359.55 g/mol. Its IUPAC name is 1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol.

Molecular Properties

Compound Name1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol
PubChem CID70218131
Molecular FormulaC23H37NO2
Molecular Weight359.55 g/mol
Exact Mass359.28
IUPAC Name1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol
SMILESCCOc1ccccc1C1CCN(C2CCCCCCCCC2)CC1O
InChIInChI=1S/C23H37NO2/c1-2-26-23-15-11-10-14-21(23)20-16-17-24(18-22(20)25)19-12-8-6-4-3-5-7-9-13-19/h10-11,14-15,19-20,22,25H,2-9,12-13,16-18H2,1H3
InChIKeyNLTJDWFSXBRQGZ-UHFFFAOYSA-N
XLogP5.13
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.55
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol?
The IUPAC name of 1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol (CID 70218131) is 1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol.
What is the SMILES notation for 1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol?
The canonical SMILES for 1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol is CCOc1ccccc1C1CCN(C2CCCCCCCCC2)CC1O.
What is the InChIKey of 1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol?
The InChIKey is NLTJDWFSXBRQGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H37NO2/c1-2-26-23-15-11-10-14-21(23)20-16-17-24(18-22(20)25)19-12-8-6-4-3-5-7-9-13-19/h10-11,14-15,19-20,22,25H,2-9,12-13,16-18H2,1H3.
What are the key properties of 1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol?
1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol has a molecular weight of 359.55 g/mol, XLogP of 5.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclodecyl-4-(2-ethoxyphenyl)piperidin-3-ol is sourced from PubChem (CID 70218131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).