2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol

C15H24N2O — CID 83990423

IUPAC2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol
SMILESCCNC1CC(CCO)CN(c2ccccc2)C1
InChIInChI=1S/C15H24N2O/c1-2-16-14-10-13(8-9-18)11-17(12-14)15-6-4-3-5-7-15/h3-7,13-14,16,18H,2,8-12H2,1H3
InChIKeyIJLLXNLUABMZHC-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.87
Rot. Bonds5

About 2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol

2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol (PubChem CID 83990423) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol
PubChem CID83990423
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol
SMILESCCNC1CC(CCO)CN(c2ccccc2)C1
InChIInChI=1S/C15H24N2O/c1-2-16-14-10-13(8-9-18)11-17(12-14)15-6-4-3-5-7-15/h3-7,13-14,16,18H,2,8-12H2,1H3
InChIKeyIJLLXNLUABMZHC-UHFFFAOYSA-N
XLogP1.87
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol?
The IUPAC name of 2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol (CID 83990423) is 2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol.
What is the SMILES notation for 2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol?
The canonical SMILES for 2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol is CCNC1CC(CCO)CN(c2ccccc2)C1.
What is the InChIKey of 2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol?
The InChIKey is IJLLXNLUABMZHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-2-16-14-10-13(8-9-18)11-17(12-14)15-6-4-3-5-7-15/h3-7,13-14,16,18H,2,8-12H2,1H3.
What are the key properties of 2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol?
2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol has a molecular weight of 248.37 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(ethylamino)-1-phenylpiperidin-3-yl]ethanol is sourced from PubChem (CID 83990423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).