2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol

C12H26N2O — CID 43174927

IUPAC2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol
SMILESCCC(CCN)N1CCCCC1CCO
InChIInChI=1S/C12H26N2O/c1-2-11(6-8-13)14-9-4-3-5-12(14)7-10-15/h11-12,15H,2-10,13H2,1H3
InChIKeyBMDBQMXBHRTVFJ-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.35
Rot. Bonds6

About 2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol

2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol (PubChem CID 43174927) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol
PubChem CID43174927
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol
SMILESCCC(CCN)N1CCCCC1CCO
InChIInChI=1S/C12H26N2O/c1-2-11(6-8-13)14-9-4-3-5-12(14)7-10-15/h11-12,15H,2-10,13H2,1H3
InChIKeyBMDBQMXBHRTVFJ-UHFFFAOYSA-N
XLogP1.35
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol (CID 43174927) is 2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol is CCC(CCN)N1CCCCC1CCO.
What is the InChIKey of 2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol?
The InChIKey is BMDBQMXBHRTVFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-2-11(6-8-13)14-9-4-3-5-12(14)7-10-15/h11-12,15H,2-10,13H2,1H3.
What are the key properties of 2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol?
2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol has a molecular weight of 214.35 g/mol, XLogP of 1.35, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1-aminopentan-3-yl)piperidin-2-yl]ethanol is sourced from PubChem (CID 43174927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).