N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide

C13H20N4O2 — CID 55168297

IUPACN-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide
SMILESCN(CCN1CCNCC1)C(=O)c1ccc[nH]c1=O
InChIInChI=1S/C13H20N4O2/c1-16(9-10-17-7-5-14-6-8-17)13(19)11-3-2-4-15-12(11)18/h2-4,14H,5-10H2,1H3,(H,15,18)
InChIKeyVWXQCIQMQQUAQI-UHFFFAOYSA-N
MW264.33 g/mol
LogP-0.65
Rot. Bonds4

About N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide

N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide (PubChem CID 55168297) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide
PubChem CID55168297
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide
SMILESCN(CCN1CCNCC1)C(=O)c1ccc[nH]c1=O
InChIInChI=1S/C13H20N4O2/c1-16(9-10-17-7-5-14-6-8-17)13(19)11-3-2-4-15-12(11)18/h2-4,14H,5-10H2,1H3,(H,15,18)
InChIKeyVWXQCIQMQQUAQI-UHFFFAOYSA-N
XLogP-0.65
TPSA68.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-0.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,3-dihydroxy-N-methyl-N-(2-piperazin-1-ylethyl)benzamide
CID 114345025
2,3-dichloro-N-methyl-N-(2-piperazin-1-ylethyl)benzamide
CID 63265748
2-fluoro-N,3-dimethyl-N-(2-piperazin-1-ylethyl)benzamide
CID 81477116
N-methyl-N-(2-piperazin-1-ylethyl)benzamide
CID 63265460
2,4-dihydroxy-N-methyl-N-(2-piperazin-1-ylethyl)benzamide
CID 63265416
N-methyl-N-(2-piperazin-1-ylethyl)-1-benzothiophene-3-carboxamide
CID 63265449
N-methyl-N-(2-piperazin-1-ylethyl)pyridine-4-carboxamide
CID 63265506
3-chloro-N-methyl-N-(2-piperazin-1-ylethyl)benzamide
CID 63265586
N,3,6-trimethyl-N-(2-piperazin-1-ylethyl)pyridazine-4-carboxamide
CID 104671415
N-methyl-N-(2-piperazin-1-ylethyl)-1H-indazole-3-carboxamide
CID 63265749
N,2-dimethyl-N-(2-piperazin-1-ylethyl)propanamide
CID 63265503
1-(2,2-difluoroethyl)-N-methyl-N-(2-piperazin-1-ylethyl)pyrrole-2-carboxamide
CID 114610245

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide (CID 55168297) is N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide is CN(CCN1CCNCC1)C(=O)c1ccc[nH]c1=O.
What is the InChIKey of N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide?
The InChIKey is VWXQCIQMQQUAQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-16(9-10-17-7-5-14-6-8-17)13(19)11-3-2-4-15-12(11)18/h2-4,14H,5-10H2,1H3,(H,15,18).
What are the key properties of N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide?
N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide has a molecular weight of 264.33 g/mol, XLogP of -0.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 55168297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).