1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol

C11H24N2O — CID 121202994

IUPAC1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol
SMILESCC(C)CC1CN(CCN)CCC1O
InChIInChI=1S/C11H24N2O/c1-9(2)7-10-8-13(6-4-12)5-3-11(10)14/h9-11,14H,3-8,12H2,1-2H3
InChIKeyXVWTZXVRMHWTGH-UHFFFAOYSA-N
MW200.33 g/mol
LogP0.67
Rot. Bonds4

About 1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol

1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol (PubChem CID 121202994) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol.

Molecular Properties

Compound Name1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol
PubChem CID121202994
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol
SMILESCC(C)CC1CN(CCN)CCC1O
InChIInChI=1S/C11H24N2O/c1-9(2)7-10-8-13(6-4-12)5-3-11(10)14/h9-11,14H,3-8,12H2,1-2H3
InChIKeyXVWTZXVRMHWTGH-UHFFFAOYSA-N
XLogP0.67
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol?
The IUPAC name of 1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol (CID 121202994) is 1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol.
What is the SMILES notation for 1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol?
The canonical SMILES for 1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol is CC(C)CC1CN(CCN)CCC1O.
What is the InChIKey of 1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol?
The InChIKey is XVWTZXVRMHWTGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-9(2)7-10-8-13(6-4-12)5-3-11(10)14/h9-11,14H,3-8,12H2,1-2H3.
What are the key properties of 1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol?
1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol has a molecular weight of 200.33 g/mol, XLogP of 0.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoethyl)-3-(2-methylpropyl)piperidin-4-ol is sourced from PubChem (CID 121202994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).