(4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone

C11H21N3O — CID 154266528

IUPAC(4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone
SMILESNC1CCN(C(=O)[C@@H]2CCCCN2)CC1
InChIInChI=1S/C11H21N3O/c12-9-4-7-14(8-5-9)11(15)10-3-1-2-6-13-10/h9-10,13H,1-8,12H2/t10-/m0/s1
InChIKeyHZGOJJKBUZPAGD-JTQLQIEISA-N
MW211.31 g/mol
LogP0.08
Rot. Bonds1

About (4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone

(4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone (PubChem CID 154266528) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is (4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone.

Molecular Properties

Compound Name(4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone
PubChem CID154266528
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name(4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone
SMILESNC1CCN(C(=O)[C@@H]2CCCCN2)CC1
InChIInChI=1S/C11H21N3O/c12-9-4-7-14(8-5-9)11(15)10-3-1-2-6-13-10/h9-10,13H,1-8,12H2/t10-/m0/s1
InChIKeyHZGOJJKBUZPAGD-JTQLQIEISA-N
XLogP0.08
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone?
The IUPAC name of (4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone (CID 154266528) is (4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone.
What is the SMILES notation for (4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone?
The canonical SMILES for (4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone is NC1CCN(C(=O)[C@@H]2CCCCN2)CC1.
What is the InChIKey of (4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone?
The InChIKey is HZGOJJKBUZPAGD-JTQLQIEISA-N. The full InChI is InChI=1S/C11H21N3O/c12-9-4-7-14(8-5-9)11(15)10-3-1-2-6-13-10/h9-10,13H,1-8,12H2/t10-/m0/s1.
What are the key properties of (4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone?
(4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone has a molecular weight of 211.31 g/mol, XLogP of 0.08, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone is sourced from PubChem (CID 154266528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).