N-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide

C12H21N3O2 — CID 78983926

IUPACN-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCN1CCC(N(C)C(=O)C2CNC(=O)C2)CC1
InChIInChI=1S/C12H21N3O2/c1-14-5-3-10(4-6-14)15(2)12(17)9-7-11(16)13-8-9/h9-10H,3-8H2,1-2H3,(H,13,16)
InChIKeyAOALLIUYNUWPLT-UHFFFAOYSA-N
MW239.32 g/mol
LogP-0.32
Rot. Bonds2

About N-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide

N-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 78983926) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is N-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide
PubChem CID78983926
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC NameN-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCN1CCC(N(C)C(=O)C2CNC(=O)C2)CC1
InChIInChI=1S/C12H21N3O2/c1-14-5-3-10(4-6-14)15(2)12(17)9-7-11(16)13-8-9/h9-10H,3-8H2,1-2H3,(H,13,16)
InChIKeyAOALLIUYNUWPLT-UHFFFAOYSA-N
XLogP-0.32
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N-methyl-5-oxopyrrolidine-3-carboxamide
CID 78983294
N-(4-aminocyclohexyl)-N-methyl-5-oxopyrrolidine-3-carboxamide
CID 81485103
N-cyclopentyl-N-methyl-6-oxopiperidine-3-carboxamide
CID 112728719
N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide
CID 78968206
N-(4-hydroxycyclohexyl)-N,1-dimethylpiperidine-4-carboxamide
CID 115277411
1-[methyl-(1-methylpiperidin-4-yl)carbamoyl]-5-oxopiperazine-2-carboxylic acid
CID 107437605
N-methyl-N-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
CID 84578867
N-cyclobutyl-N-methyl-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901759
N-[2-(dimethylamino)-2-oxoethyl]-5-oxo-N-propylpyrrolidine-3-carboxamide
CID 78982846
(3S)-N-cyclohexyl-N,1-dimethylpyrrolidine-3-carboxamide
CID 134459471
(3R)-N-cyclohexyl-N,1-dimethylpyrrolidine-3-carboxamide
CID 134459454
3-amino-N,4-dimethyl-N-(1-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 62776343

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide (CID 78983926) is N-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide is CN1CCC(N(C)C(=O)C2CNC(=O)C2)CC1.
What is the InChIKey of N-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is AOALLIUYNUWPLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-14-5-3-10(4-6-14)15(2)12(17)9-7-11(16)13-8-9/h9-10H,3-8H2,1-2H3,(H,13,16).
What are the key properties of N-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide?
N-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 239.32 g/mol, XLogP of -0.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 78983926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).