2-[(2-methylpiperidin-4-yl)amino]ethanol

C8H18N2O — CID 164646040

IUPAC2-[(2-methylpiperidin-4-yl)amino]ethanol
SMILESCC1CC(NCCO)CCN1
InChIInChI=1S/C8H18N2O/c1-7-6-8(2-3-9-7)10-4-5-11/h7-11H,2-6H2,1H3
InChIKeyIKGKEXZTEUPKER-UHFFFAOYSA-N
MW158.24 g/mol
LogP-0.29
Rot. Bonds3

About 2-[(2-methylpiperidin-4-yl)amino]ethanol

2-[(2-methylpiperidin-4-yl)amino]ethanol (PubChem CID 164646040) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 2-[(2-methylpiperidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(2-methylpiperidin-4-yl)amino]ethanol
PubChem CID164646040
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name2-[(2-methylpiperidin-4-yl)amino]ethanol
SMILESCC1CC(NCCO)CCN1
InChIInChI=1S/C8H18N2O/c1-7-6-8(2-3-9-7)10-4-5-11/h7-11H,2-6H2,1H3
InChIKeyIKGKEXZTEUPKER-UHFFFAOYSA-N
XLogP-0.29
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpiperidin-4-yl)amino]ethanol?
The IUPAC name of 2-[(2-methylpiperidin-4-yl)amino]ethanol (CID 164646040) is 2-[(2-methylpiperidin-4-yl)amino]ethanol.
What is the SMILES notation for 2-[(2-methylpiperidin-4-yl)amino]ethanol?
The canonical SMILES for 2-[(2-methylpiperidin-4-yl)amino]ethanol is CC1CC(NCCO)CCN1.
What is the InChIKey of 2-[(2-methylpiperidin-4-yl)amino]ethanol?
The InChIKey is IKGKEXZTEUPKER-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-7-6-8(2-3-9-7)10-4-5-11/h7-11H,2-6H2,1H3.
What are the key properties of 2-[(2-methylpiperidin-4-yl)amino]ethanol?
2-[(2-methylpiperidin-4-yl)amino]ethanol has a molecular weight of 158.24 g/mol, XLogP of -0.29, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpiperidin-4-yl)amino]ethanol is sourced from PubChem (CID 164646040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).