4-(2-aminoethyl)-1-benzylpiperidin-4-ol

C14H22N2O — CID 18351405

IUPAC4-(2-aminoethyl)-1-benzylpiperidin-4-ol
SMILESNCCC1(O)CCN(Cc2ccccc2)CC1
InChIInChI=1S/C14H22N2O/c15-9-6-14(17)7-10-16(11-8-14)12-13-4-2-1-3-5-13/h1-5,17H,6-12,15H2
InChIKeyLAXOSLOZUNLMBZ-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.36
Rot. Bonds4

About 4-(2-aminoethyl)-1-benzylpiperidin-4-ol

4-(2-aminoethyl)-1-benzylpiperidin-4-ol (PubChem CID 18351405) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 4-(2-aminoethyl)-1-benzylpiperidin-4-ol.

Molecular Properties

Compound Name4-(2-aminoethyl)-1-benzylpiperidin-4-ol
PubChem CID18351405
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name4-(2-aminoethyl)-1-benzylpiperidin-4-ol
SMILESNCCC1(O)CCN(Cc2ccccc2)CC1
InChIInChI=1S/C14H22N2O/c15-9-6-14(17)7-10-16(11-8-14)12-13-4-2-1-3-5-13/h1-5,17H,6-12,15H2
InChIKeyLAXOSLOZUNLMBZ-UHFFFAOYSA-N
XLogP1.36
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-aminoethyl)-1-benzylpiperidin-4-ol?
The IUPAC name of 4-(2-aminoethyl)-1-benzylpiperidin-4-ol (CID 18351405) is 4-(2-aminoethyl)-1-benzylpiperidin-4-ol.
What is the SMILES notation for 4-(2-aminoethyl)-1-benzylpiperidin-4-ol?
The canonical SMILES for 4-(2-aminoethyl)-1-benzylpiperidin-4-ol is NCCC1(O)CCN(Cc2ccccc2)CC1.
What is the InChIKey of 4-(2-aminoethyl)-1-benzylpiperidin-4-ol?
The InChIKey is LAXOSLOZUNLMBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c15-9-6-14(17)7-10-16(11-8-14)12-13-4-2-1-3-5-13/h1-5,17H,6-12,15H2.
What are the key properties of 4-(2-aminoethyl)-1-benzylpiperidin-4-ol?
4-(2-aminoethyl)-1-benzylpiperidin-4-ol has a molecular weight of 234.34 g/mol, XLogP of 1.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoethyl)-1-benzylpiperidin-4-ol is sourced from PubChem (CID 18351405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).