N-[(3S)-2-oxopiperidin-3-yl]acetamide

C7H12N2O2 — CID 14289831

IUPACN-[(3S)-2-oxopiperidin-3-yl]acetamide
SMILESCC(=O)N[C@H]1CCCNC1=O
InChIInChI=1S/C7H12N2O2/c1-5(10)9-6-3-2-4-8-7(6)11/h6H,2-4H2,1H3,(H,8,11)(H,9,10)/t6-/m0/s1
InChIKeyNXGOJJKVSDOOGU-LURJTMIESA-N
MW156.19 g/mol
LogP-0.60
Rot. Bonds1

About N-[(3S)-2-oxopiperidin-3-yl]acetamide

N-[(3S)-2-oxopiperidin-3-yl]acetamide (PubChem CID 14289831) has the molecular formula C7H12N2O2 and a molecular weight of 156.19 g/mol. Its IUPAC name is N-[(3S)-2-oxopiperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[(3S)-2-oxopiperidin-3-yl]acetamide
PubChem CID14289831
Molecular FormulaC7H12N2O2
Molecular Weight156.19 g/mol
Exact Mass156.09
IUPAC NameN-[(3S)-2-oxopiperidin-3-yl]acetamide
SMILESCC(=O)N[C@H]1CCCNC1=O
InChIInChI=1S/C7H12N2O2/c1-5(10)9-6-3-2-4-8-7(6)11/h6H,2-4H2,1H3,(H,8,11)(H,9,10)/t6-/m0/s1
InChIKeyNXGOJJKVSDOOGU-LURJTMIESA-N
XLogP-0.60
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(3S)-2-oxopiperidin-3-yl]acetamide?
The IUPAC name of N-[(3S)-2-oxopiperidin-3-yl]acetamide (CID 14289831) is N-[(3S)-2-oxopiperidin-3-yl]acetamide.
What is the SMILES notation for N-[(3S)-2-oxopiperidin-3-yl]acetamide?
The canonical SMILES for N-[(3S)-2-oxopiperidin-3-yl]acetamide is CC(=O)N[C@H]1CCCNC1=O.
What is the InChIKey of N-[(3S)-2-oxopiperidin-3-yl]acetamide?
The InChIKey is NXGOJJKVSDOOGU-LURJTMIESA-N. The full InChI is InChI=1S/C7H12N2O2/c1-5(10)9-6-3-2-4-8-7(6)11/h6H,2-4H2,1H3,(H,8,11)(H,9,10)/t6-/m0/s1.
What are the key properties of N-[(3S)-2-oxopiperidin-3-yl]acetamide?
N-[(3S)-2-oxopiperidin-3-yl]acetamide has a molecular weight of 156.19 g/mol, XLogP of -0.60, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-2-oxopiperidin-3-yl]acetamide is sourced from PubChem (CID 14289831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).