2-[1-(aminomethyl)piperidin-4-yl]ethanol

C8H18N2O — CID 70226868

IUPAC2-[1-(aminomethyl)piperidin-4-yl]ethanol
SMILESNCN1CCC(CCO)CC1
InChIInChI=1S/C8H18N2O/c9-7-10-4-1-8(2-5-10)3-6-11/h8,11H,1-7,9H2
InChIKeyKPODETPCWOEJAJ-UHFFFAOYSA-N
MW158.24 g/mol
LogP-0.00
Rot. Bonds3

About 2-[1-(aminomethyl)piperidin-4-yl]ethanol

2-[1-(aminomethyl)piperidin-4-yl]ethanol (PubChem CID 70226868) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 2-[1-(aminomethyl)piperidin-4-yl]ethanol.

Molecular Properties

Compound Name2-[1-(aminomethyl)piperidin-4-yl]ethanol
PubChem CID70226868
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name2-[1-(aminomethyl)piperidin-4-yl]ethanol
SMILESNCN1CCC(CCO)CC1
InChIInChI=1S/C8H18N2O/c9-7-10-4-1-8(2-5-10)3-6-11/h8,11H,1-7,9H2
InChIKeyKPODETPCWOEJAJ-UHFFFAOYSA-N
XLogP-0.00
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)piperidin-4-yl]ethanol?
The IUPAC name of 2-[1-(aminomethyl)piperidin-4-yl]ethanol (CID 70226868) is 2-[1-(aminomethyl)piperidin-4-yl]ethanol.
What is the SMILES notation for 2-[1-(aminomethyl)piperidin-4-yl]ethanol?
The canonical SMILES for 2-[1-(aminomethyl)piperidin-4-yl]ethanol is NCN1CCC(CCO)CC1.
What is the InChIKey of 2-[1-(aminomethyl)piperidin-4-yl]ethanol?
The InChIKey is KPODETPCWOEJAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c9-7-10-4-1-8(2-5-10)3-6-11/h8,11H,1-7,9H2.
What are the key properties of 2-[1-(aminomethyl)piperidin-4-yl]ethanol?
2-[1-(aminomethyl)piperidin-4-yl]ethanol has a molecular weight of 158.24 g/mol, XLogP of -0.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)piperidin-4-yl]ethanol is sourced from PubChem (CID 70226868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).