1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol

C15H25N3O2 — CID 102955460

IUPAC1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol
SMILESCC(C)COc1nc(N2CCC(C)C(O)C2)ccc1N
InChIInChI=1S/C15H25N3O2/c1-10(2)9-20-15-12(16)4-5-14(17-15)18-7-6-11(3)13(19)8-18/h4-5,10-11,13,19H,6-9,16H2,1-3H3
InChIKeyNJMUADGBHIAVFR-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.91
Rot. Bonds4

About 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol

1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol (PubChem CID 102955460) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol.

Molecular Properties

Compound Name1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol
PubChem CID102955460
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol
SMILESCC(C)COc1nc(N2CCC(C)C(O)C2)ccc1N
InChIInChI=1S/C15H25N3O2/c1-10(2)9-20-15-12(16)4-5-14(17-15)18-7-6-11(3)13(19)8-18/h4-5,10-11,13,19H,6-9,16H2,1-3H3
InChIKeyNJMUADGBHIAVFR-UHFFFAOYSA-N
XLogP1.91
TPSA71.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol?
The IUPAC name of 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol (CID 102955460) is 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol.
What is the SMILES notation for 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol?
The canonical SMILES for 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol is CC(C)COc1nc(N2CCC(C)C(O)C2)ccc1N.
What is the InChIKey of 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol?
The InChIKey is NJMUADGBHIAVFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-10(2)9-20-15-12(16)4-5-14(17-15)18-7-6-11(3)13(19)8-18/h4-5,10-11,13,19H,6-9,16H2,1-3H3.
What are the key properties of 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol?
1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol has a molecular weight of 279.38 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-4-methylpiperidin-3-ol is sourced from PubChem (CID 102955460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).