N-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide

C13H23N3O2 — CID 11391137

IUPACN-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide
SMILESCNC(=O)C[C@H]1CCCN(C2CCNCC2)C1=O
InChIInChI=1S/C13H23N3O2/c1-14-12(17)9-10-3-2-8-16(13(10)18)11-4-6-15-7-5-11/h10-11,15H,2-9H2,1H3,(H,14,17)/t10-/m1/s1
InChIKeyCJQMFBTXYAUSDS-SNVBAGLBSA-N
MW253.35 g/mol
LogP0.11
Rot. Bonds3

About N-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide

N-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide (PubChem CID 11391137) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is N-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide
PubChem CID11391137
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC NameN-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide
SMILESCNC(=O)C[C@H]1CCCN(C2CCNCC2)C1=O
InChIInChI=1S/C13H23N3O2/c1-14-12(17)9-10-3-2-8-16(13(10)18)11-4-6-15-7-5-11/h10-11,15H,2-9H2,1H3,(H,14,17)/t10-/m1/s1
InChIKeyCJQMFBTXYAUSDS-SNVBAGLBSA-N
XLogP0.11
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide?
The IUPAC name of N-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide (CID 11391137) is N-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide.
What is the SMILES notation for N-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide?
The canonical SMILES for N-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide is CNC(=O)C[C@H]1CCCN(C2CCNCC2)C1=O.
What is the InChIKey of N-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide?
The InChIKey is CJQMFBTXYAUSDS-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-14-12(17)9-10-3-2-8-16(13(10)18)11-4-6-15-7-5-11/h10-11,15H,2-9H2,1H3,(H,14,17)/t10-/m1/s1.
What are the key properties of N-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide?
N-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide has a molecular weight of 253.35 g/mol, XLogP of 0.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(3R)-2-oxo-1-piperidin-4-ylpiperidin-3-yl]acetamide is sourced from PubChem (CID 11391137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).