1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one

C15H22N4O — CID 71155695

IUPAC1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one
SMILESNc1cccnc1N1CCC(N2CCCCC2=O)CC1
InChIInChI=1S/C15H22N4O/c16-13-4-3-8-17-15(13)18-10-6-12(7-11-18)19-9-2-1-5-14(19)20/h3-4,8,12H,1-2,5-7,9-11,16H2
InChIKeyIJTFEHOPQIOLOL-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.65
Rot. Bonds2

About 1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one

1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one (PubChem CID 71155695) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one.

Molecular Properties

Compound Name1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one
PubChem CID71155695
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one
SMILESNc1cccnc1N1CCC(N2CCCCC2=O)CC1
InChIInChI=1S/C15H22N4O/c16-13-4-3-8-17-15(13)18-10-6-12(7-11-18)19-9-2-1-5-14(19)20/h3-4,8,12H,1-2,5-7,9-11,16H2
InChIKeyIJTFEHOPQIOLOL-UHFFFAOYSA-N
XLogP1.65
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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4-(2-Pyridyl)piperazine-1-carboxamide
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CID 146681131
N-(6-{4-[5-(trifluoromethyl)pyridin-2-yl]piperazino}pyridin-3-yl)acetamide
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Frequently Asked Questions

What is the IUPAC name of 1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one?
The IUPAC name of 1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one (CID 71155695) is 1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one.
What is the SMILES notation for 1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one?
The canonical SMILES for 1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one is Nc1cccnc1N1CCC(N2CCCCC2=O)CC1.
What is the InChIKey of 1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one?
The InChIKey is IJTFEHOPQIOLOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c16-13-4-3-8-17-15(13)18-10-6-12(7-11-18)19-9-2-1-5-14(19)20/h3-4,8,12H,1-2,5-7,9-11,16H2.
What are the key properties of 1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one?
1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one has a molecular weight of 274.37 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(3-amino-2-pyridinyl)piperidin-4-yl]piperidin-2-one is sourced from PubChem (CID 71155695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).