2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol

C13H26N2O — CID 83989863

IUPAC2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol
SMILESCNC1CC(CCO)CN(C2CCCC2)C1
InChIInChI=1S/C13H26N2O/c1-14-12-8-11(6-7-16)9-15(10-12)13-4-2-3-5-13/h11-14,16H,2-10H2,1H3
InChIKeyMGALJUSAEIBMFI-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.22
Rot. Bonds4

About 2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol

2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol (PubChem CID 83989863) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol
PubChem CID83989863
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol
SMILESCNC1CC(CCO)CN(C2CCCC2)C1
InChIInChI=1S/C13H26N2O/c1-14-12-8-11(6-7-16)9-15(10-12)13-4-2-3-5-13/h11-14,16H,2-10H2,1H3
InChIKeyMGALJUSAEIBMFI-UHFFFAOYSA-N
XLogP1.22
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol?
The IUPAC name of 2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol (CID 83989863) is 2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol.
What is the SMILES notation for 2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol?
The canonical SMILES for 2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol is CNC1CC(CCO)CN(C2CCCC2)C1.
What is the InChIKey of 2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol?
The InChIKey is MGALJUSAEIBMFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-14-12-8-11(6-7-16)9-15(10-12)13-4-2-3-5-13/h11-14,16H,2-10H2,1H3.
What are the key properties of 2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol?
2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol has a molecular weight of 226.36 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol is sourced from PubChem (CID 83989863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).