(4S)-4-aminopiperidin-2-one;hydrochloride

C5H11ClN2O — CID 22841787

IUPAC(4S)-4-aminopiperidin-2-one;hydrochloride
SMILESCl.N[C@H]1CCNC(=O)C1
InChIInChI=1S/C5H10N2O.ClH/c6-4-1-2-7-5(8)3-4;/h4H,1-3,6H2,(H,7,8);1H/t4-;/m0./s1
InChIKeyCCWIFZGLLVKIRH-WCCKRBBISA-N
MW150.61 g/mol
LogP-0.35
Rot. Bonds

About (4S)-4-aminopiperidin-2-one;hydrochloride

(4S)-4-aminopiperidin-2-one;hydrochloride (PubChem CID 22841787) has the molecular formula C5H11ClN2O and a molecular weight of 150.61 g/mol. Its IUPAC name is (4S)-4-aminopiperidin-2-one;hydrochloride.

Molecular Properties

Compound Name(4S)-4-aminopiperidin-2-one;hydrochloride
PubChem CID22841787
Molecular FormulaC5H11ClN2O
Molecular Weight150.61 g/mol
Exact Mass150.06
IUPAC Name(4S)-4-aminopiperidin-2-one;hydrochloride
SMILESCl.N[C@H]1CCNC(=O)C1
InChIInChI=1S/C5H10N2O.ClH/c6-4-1-2-7-5(8)3-4;/h4H,1-3,6H2,(H,7,8);1H/t4-;/m0./s1
InChIKeyCCWIFZGLLVKIRH-WCCKRBBISA-N
XLogP-0.35
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.61
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4S)-4-aminopiperidin-2-one;hydrochloride?
The IUPAC name of (4S)-4-aminopiperidin-2-one;hydrochloride (CID 22841787) is (4S)-4-aminopiperidin-2-one;hydrochloride.
What is the SMILES notation for (4S)-4-aminopiperidin-2-one;hydrochloride?
The canonical SMILES for (4S)-4-aminopiperidin-2-one;hydrochloride is Cl.N[C@H]1CCNC(=O)C1.
What is the InChIKey of (4S)-4-aminopiperidin-2-one;hydrochloride?
The InChIKey is CCWIFZGLLVKIRH-WCCKRBBISA-N. The full InChI is InChI=1S/C5H10N2O.ClH/c6-4-1-2-7-5(8)3-4;/h4H,1-3,6H2,(H,7,8);1H/t4-;/m0./s1.
What are the key properties of (4S)-4-aminopiperidin-2-one;hydrochloride?
(4S)-4-aminopiperidin-2-one;hydrochloride has a molecular weight of 150.61 g/mol, XLogP of -0.35, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-aminopiperidin-2-one;hydrochloride is sourced from PubChem (CID 22841787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).