N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide

C11H19N3O2 — CID 103796632

IUPACN-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide
SMILESCN1CCC(NC(=O)C2CCCNC2)C1=O
InChIInChI=1S/C11H19N3O2/c1-14-6-4-9(11(14)16)13-10(15)8-3-2-5-12-7-8/h8-9,12H,2-7H2,1H3,(H,13,15)
InChIKeyDORDPGVLTQUAJN-UHFFFAOYSA-N
MW225.29 g/mol
LogP-0.67
Rot. Bonds2

About N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide

N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide (PubChem CID 103796632) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide
PubChem CID103796632
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC NameN-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide
SMILESCN1CCC(NC(=O)C2CCCNC2)C1=O
InChIInChI=1S/C11H19N3O2/c1-14-6-4-9(11(14)16)13-10(15)8-3-2-5-12-7-8/h8-9,12H,2-7H2,1H3,(H,13,15)
InChIKeyDORDPGVLTQUAJN-UHFFFAOYSA-N
XLogP-0.67
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 5-0.67
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)piperidine-3-carboxamide?
The IUPAC name of N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide (CID 103796632) is N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide.
What is the SMILES notation for N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide?
The canonical SMILES for N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide is CN1CCC(NC(=O)C2CCCNC2)C1=O.
What is the InChIKey of N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide?
The InChIKey is DORDPGVLTQUAJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-14-6-4-9(11(14)16)13-10(15)8-3-2-5-12-7-8/h8-9,12H,2-7H2,1H3,(H,13,15).
What are the key properties of N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide?
N-(1-methyl-2-oxopyrrolidin-3-yl)piperidine-3-carboxamide has a molecular weight of 225.29 g/mol, XLogP of -0.67, 2 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)piperidine-3-carboxamide is sourced from PubChem (CID 103796632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).