N-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide

C12H21N3O2 — CID 106256007

IUPACN-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide
SMILESCN1CCC(NC(=O)CC2CCCNC2)C1=O
InChIInChI=1S/C12H21N3O2/c1-15-6-4-10(12(15)17)14-11(16)7-9-3-2-5-13-8-9/h9-10,13H,2-8H2,1H3,(H,14,16)
InChIKeyUCEJFSXNHMTPCZ-UHFFFAOYSA-N
MW239.32 g/mol
LogP-0.28
Rot. Bonds3

About N-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide

N-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide (PubChem CID 106256007) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is N-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide.

Molecular Properties

Compound NameN-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide
PubChem CID106256007
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC NameN-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide
SMILESCN1CCC(NC(=O)CC2CCCNC2)C1=O
InChIInChI=1S/C12H21N3O2/c1-15-6-4-10(12(15)17)14-11(16)7-9-3-2-5-13-8-9/h9-10,13H,2-8H2,1H3,(H,14,16)
InChIKeyUCEJFSXNHMTPCZ-UHFFFAOYSA-N
XLogP-0.28
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide?
The IUPAC name of N-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide (CID 106256007) is N-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide.
What is the SMILES notation for N-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide?
The canonical SMILES for N-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide is CN1CCC(NC(=O)CC2CCCNC2)C1=O.
What is the InChIKey of N-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide?
The InChIKey is UCEJFSXNHMTPCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-15-6-4-10(12(15)17)14-11(16)7-9-3-2-5-13-8-9/h9-10,13H,2-8H2,1H3,(H,14,16).
What are the key properties of N-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide?
N-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide has a molecular weight of 239.32 g/mol, XLogP of -0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-2-oxopyrrolidin-3-yl)-2-piperidin-3-ylacetamide is sourced from PubChem (CID 106256007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).