2-(5-amino-1-propylpiperidin-3-yl)ethanol

C10H22N2O — CID 83989015

IUPAC2-(5-amino-1-propylpiperidin-3-yl)ethanol
SMILESCCCN1CC(N)CC(CCO)C1
InChIInChI=1S/C10H22N2O/c1-2-4-12-7-9(3-5-13)6-10(11)8-12/h9-10,13H,2-8,11H2,1H3
InChIKeyHFNRFQZPTOJCJS-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.43
Rot. Bonds4

About 2-(5-amino-1-propylpiperidin-3-yl)ethanol

2-(5-amino-1-propylpiperidin-3-yl)ethanol (PubChem CID 83989015) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 2-(5-amino-1-propylpiperidin-3-yl)ethanol.

Molecular Properties

Compound Name2-(5-amino-1-propylpiperidin-3-yl)ethanol
PubChem CID83989015
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name2-(5-amino-1-propylpiperidin-3-yl)ethanol
SMILESCCCN1CC(N)CC(CCO)C1
InChIInChI=1S/C10H22N2O/c1-2-4-12-7-9(3-5-13)6-10(11)8-12/h9-10,13H,2-8,11H2,1H3
InChIKeyHFNRFQZPTOJCJS-UHFFFAOYSA-N
XLogP0.43
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-1-propylpiperidin-3-yl)ethanol?
The IUPAC name of 2-(5-amino-1-propylpiperidin-3-yl)ethanol (CID 83989015) is 2-(5-amino-1-propylpiperidin-3-yl)ethanol.
What is the SMILES notation for 2-(5-amino-1-propylpiperidin-3-yl)ethanol?
The canonical SMILES for 2-(5-amino-1-propylpiperidin-3-yl)ethanol is CCCN1CC(N)CC(CCO)C1.
What is the InChIKey of 2-(5-amino-1-propylpiperidin-3-yl)ethanol?
The InChIKey is HFNRFQZPTOJCJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-2-4-12-7-9(3-5-13)6-10(11)8-12/h9-10,13H,2-8,11H2,1H3.
What are the key properties of 2-(5-amino-1-propylpiperidin-3-yl)ethanol?
2-(5-amino-1-propylpiperidin-3-yl)ethanol has a molecular weight of 186.30 g/mol, XLogP of 0.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-1-propylpiperidin-3-yl)ethanol is sourced from PubChem (CID 83989015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).