[(4R)-2-oxopiperidin-4-yl]azanium

C5H11N2O+ — CID 27282256

IUPAC[(4R)-2-oxopiperidin-4-yl]azanium
SMILES[NH3+][C@@H]1CCNC(=O)C1
InChIInChI=1S/C5H10N2O/c6-4-1-2-7-5(8)3-4/h4H,1-3,6H2,(H,7,8)/p+1/t4-/m1/s1
InChIKeySLZBOFGNZPNOOK-SCSAIBSYSA-O
MW115.16 g/mol
LogP-1.49
Rot. Bonds

About [(4R)-2-oxopiperidin-4-yl]azanium

[(4R)-2-oxopiperidin-4-yl]azanium (PubChem CID 27282256) has the molecular formula C5H11N2O+ and a molecular weight of 115.16 g/mol. Its IUPAC name is [(4R)-2-oxopiperidin-4-yl]azanium.

Molecular Properties

Compound Name[(4R)-2-oxopiperidin-4-yl]azanium
PubChem CID27282256
Molecular FormulaC5H11N2O+
Molecular Weight115.16 g/mol
Exact Mass115.09
IUPAC Name[(4R)-2-oxopiperidin-4-yl]azanium
SMILES[NH3+][C@@H]1CCNC(=O)C1
InChIInChI=1S/C5H10N2O/c6-4-1-2-7-5(8)3-4/h4H,1-3,6H2,(H,7,8)/p+1/t4-/m1/s1
InChIKeySLZBOFGNZPNOOK-SCSAIBSYSA-O
XLogP-1.49
TPSA56.74 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.16
LogP ≤ 5-1.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [(4R)-2-oxopiperidin-4-yl]azanium?
The IUPAC name of [(4R)-2-oxopiperidin-4-yl]azanium (CID 27282256) is [(4R)-2-oxopiperidin-4-yl]azanium.
What is the SMILES notation for [(4R)-2-oxopiperidin-4-yl]azanium?
The canonical SMILES for [(4R)-2-oxopiperidin-4-yl]azanium is [NH3+][C@@H]1CCNC(=O)C1.
What is the InChIKey of [(4R)-2-oxopiperidin-4-yl]azanium?
The InChIKey is SLZBOFGNZPNOOK-SCSAIBSYSA-O. The full InChI is InChI=1S/C5H10N2O/c6-4-1-2-7-5(8)3-4/h4H,1-3,6H2,(H,7,8)/p+1/t4-/m1/s1.
What are the key properties of [(4R)-2-oxopiperidin-4-yl]azanium?
[(4R)-2-oxopiperidin-4-yl]azanium has a molecular weight of 115.16 g/mol, XLogP of -1.49, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-2-oxopiperidin-4-yl]azanium is sourced from PubChem (CID 27282256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).