1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol

C11H15Cl2N3O — CID 102759205

IUPAC1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol
SMILESCC1(O)CCN(c2nc(N)c(Cl)cc2Cl)CC1
InChIInChI=1S/C11H15Cl2N3O/c1-11(17)2-4-16(5-3-11)10-8(13)6-7(12)9(14)15-10/h6,17H,2-5H2,1H3,(H2,14,15)
InChIKeyREFJIJNKSIDWID-UHFFFAOYSA-N
MW276.17 g/mol
LogP2.32
Rot. Bonds1

About 1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol

1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol (PubChem CID 102759205) has the molecular formula C11H15Cl2N3O and a molecular weight of 276.17 g/mol. Its IUPAC name is 1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol
PubChem CID102759205
Molecular FormulaC11H15Cl2N3O
Molecular Weight276.17 g/mol
Exact Mass275.06
IUPAC Name1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol
SMILESCC1(O)CCN(c2nc(N)c(Cl)cc2Cl)CC1
InChIInChI=1S/C11H15Cl2N3O/c1-11(17)2-4-16(5-3-11)10-8(13)6-7(12)9(14)15-10/h6,17H,2-5H2,1H3,(H2,14,15)
InChIKeyREFJIJNKSIDWID-UHFFFAOYSA-N
XLogP2.32
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.17
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol?
The IUPAC name of 1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol (CID 102759205) is 1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol.
What is the SMILES notation for 1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol?
The canonical SMILES for 1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol is CC1(O)CCN(c2nc(N)c(Cl)cc2Cl)CC1.
What is the InChIKey of 1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol?
The InChIKey is REFJIJNKSIDWID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15Cl2N3O/c1-11(17)2-4-16(5-3-11)10-8(13)6-7(12)9(14)15-10/h6,17H,2-5H2,1H3,(H2,14,15).
What are the key properties of 1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol?
1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol has a molecular weight of 276.17 g/mol, XLogP of 2.32, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol is sourced from PubChem (CID 102759205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).