2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol

C15H30N2O2 — CID 55066329

IUPAC2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol
SMILESCNCC1(CN2CCCCC2CCO)CCOCC1
InChIInChI=1S/C15H30N2O2/c1-16-12-15(6-10-19-11-7-15)13-17-8-3-2-4-14(17)5-9-18/h14,16,18H,2-13H2,1H3
InChIKeyCZBLUESMGNXKLZ-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.24
Rot. Bonds6

About 2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol

2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol (PubChem CID 55066329) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol
PubChem CID55066329
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol
SMILESCNCC1(CN2CCCCC2CCO)CCOCC1
InChIInChI=1S/C15H30N2O2/c1-16-12-15(6-10-19-11-7-15)13-17-8-3-2-4-14(17)5-9-18/h14,16,18H,2-13H2,1H3
InChIKeyCZBLUESMGNXKLZ-UHFFFAOYSA-N
XLogP1.24
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol (CID 55066329) is 2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol is CNCC1(CN2CCCCC2CCO)CCOCC1.
What is the InChIKey of 2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol?
The InChIKey is CZBLUESMGNXKLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-16-12-15(6-10-19-11-7-15)13-17-8-3-2-4-14(17)5-9-18/h14,16,18H,2-13H2,1H3.
What are the key properties of 2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol?
2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol has a molecular weight of 270.42 g/mol, XLogP of 1.24, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[4-(methylaminomethyl)oxan-4-yl]methyl]piperidin-2-yl]ethanol is sourced from PubChem (CID 55066329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).