N-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide

C13H23N3O3 — CID 64669415

IUPACN-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide
SMILESCN1CC(NC(=O)COC2CCNCC2)CCC1=O
InChIInChI=1S/C13H23N3O3/c1-16-8-10(2-3-13(16)18)15-12(17)9-19-11-4-6-14-7-5-11/h10-11,14H,2-9H2,1H3,(H,15,17)
InChIKeyRZBOKHUOFKWGFU-UHFFFAOYSA-N
MW269.34 g/mol
LogP-0.51
Rot. Bonds4

About N-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide

N-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide (PubChem CID 64669415) has the molecular formula C13H23N3O3 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide.

Molecular Properties

Compound NameN-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide
PubChem CID64669415
Molecular FormulaC13H23N3O3
Molecular Weight269.34 g/mol
Exact Mass269.17
IUPAC NameN-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide
SMILESCN1CC(NC(=O)COC2CCNCC2)CCC1=O
InChIInChI=1S/C13H23N3O3/c1-16-8-10(2-3-13(16)18)15-12(17)9-19-11-4-6-14-7-5-11/h10-11,14H,2-9H2,1H3,(H,15,17)
InChIKeyRZBOKHUOFKWGFU-UHFFFAOYSA-N
XLogP-0.51
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide?
The IUPAC name of N-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide (CID 64669415) is N-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide.
What is the SMILES notation for N-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide?
The canonical SMILES for N-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide is CN1CC(NC(=O)COC2CCNCC2)CCC1=O.
What is the InChIKey of N-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide?
The InChIKey is RZBOKHUOFKWGFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O3/c1-16-8-10(2-3-13(16)18)15-12(17)9-19-11-4-6-14-7-5-11/h10-11,14H,2-9H2,1H3,(H,15,17).
What are the key properties of N-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide?
N-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide has a molecular weight of 269.34 g/mol, XLogP of -0.51, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-6-oxopiperidin-3-yl)-2-piperidin-4-yloxyacetamide is sourced from PubChem (CID 64669415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).