N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide

C11H19N3O2 — CID 114695087

IUPACN-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide
SMILESCC1NCCCC1NC(=O)C1CCC(=O)N1
InChIInChI=1S/C11H19N3O2/c1-7-8(3-2-6-12-7)14-11(16)9-4-5-10(15)13-9/h7-9,12H,2-6H2,1H3,(H,13,15)(H,14,16)
InChIKeyMALQFHRVNWSCOP-UHFFFAOYSA-N
MW225.29 g/mol
LogP-0.48
Rot. Bonds2

About N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide

N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide (PubChem CID 114695087) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide
PubChem CID114695087
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC NameN-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide
SMILESCC1NCCCC1NC(=O)C1CCC(=O)N1
InChIInChI=1S/C11H19N3O2/c1-7-8(3-2-6-12-7)14-11(16)9-4-5-10(15)13-9/h7-9,12H,2-6H2,1H3,(H,13,15)(H,14,16)
InChIKeyMALQFHRVNWSCOP-UHFFFAOYSA-N
XLogP-0.48
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 5-0.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide (CID 114695087) is N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide is CC1NCCCC1NC(=O)C1CCC(=O)N1.
What is the InChIKey of N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide?
The InChIKey is MALQFHRVNWSCOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-7-8(3-2-6-12-7)14-11(16)9-4-5-10(15)13-9/h7-9,12H,2-6H2,1H3,(H,13,15)(H,14,16).
What are the key properties of N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide?
N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide has a molecular weight of 225.29 g/mol, XLogP of -0.48, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 114695087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).