1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol

C11H17N3O — CID 114677796

IUPAC1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol
SMILESCC1CN(c2cccnc2N)CCC1O
InChIInChI=1S/C11H17N3O/c1-8-7-14(6-4-10(8)15)9-3-2-5-13-11(9)12/h2-3,5,8,10,15H,4,6-7H2,1H3,(H2,12,13)
InChIKeyUXYLIWIZVKOKEU-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.87
Rot. Bonds1

About 1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol

1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol (PubChem CID 114677796) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol
PubChem CID114677796
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol
SMILESCC1CN(c2cccnc2N)CCC1O
InChIInChI=1S/C11H17N3O/c1-8-7-14(6-4-10(8)15)9-3-2-5-13-11(9)12/h2-3,5,8,10,15H,4,6-7H2,1H3,(H2,12,13)
InChIKeyUXYLIWIZVKOKEU-UHFFFAOYSA-N
XLogP0.87
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol?
The IUPAC name of 1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol (CID 114677796) is 1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol.
What is the SMILES notation for 1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol?
The canonical SMILES for 1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol is CC1CN(c2cccnc2N)CCC1O.
What is the InChIKey of 1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol?
The InChIKey is UXYLIWIZVKOKEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-8-7-14(6-4-10(8)15)9-3-2-5-13-11(9)12/h2-3,5,8,10,15H,4,6-7H2,1H3,(H2,12,13).
What are the key properties of 1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol?
1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol has a molecular weight of 207.28 g/mol, XLogP of 0.87, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-3-pyridinyl)-3-methylpiperidin-4-ol is sourced from PubChem (CID 114677796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).