N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide

C15H24N4O2 — CID 56711357

IUPACN-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide
SMILESCC(C)CN1CCCC(CNC(=O)c2c[nH]c(=O)cn2)C1
InChIInChI=1S/C15H24N4O2/c1-11(2)9-19-5-3-4-12(10-19)6-18-15(21)13-7-17-14(20)8-16-13/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyXDTRHGSVKPFKCN-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.87
Rot. Bonds5

About N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide

N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide (PubChem CID 56711357) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide
PubChem CID56711357
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide
SMILESCC(C)CN1CCCC(CNC(=O)c2c[nH]c(=O)cn2)C1
InChIInChI=1S/C15H24N4O2/c1-11(2)9-19-5-3-4-12(10-19)6-18-15(21)13-7-17-14(20)8-16-13/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyXDTRHGSVKPFKCN-UHFFFAOYSA-N
XLogP0.87
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-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

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide?
The IUPAC name of N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide (CID 56711357) is N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide.
What is the SMILES notation for N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide?
The canonical SMILES for N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide is CC(C)CN1CCCC(CNC(=O)c2c[nH]c(=O)cn2)C1.
What is the InChIKey of N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide?
The InChIKey is XDTRHGSVKPFKCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-11(2)9-19-5-3-4-12(10-19)6-18-15(21)13-7-17-14(20)8-16-13/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,17,20)(H,18,21).
What are the key properties of N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide?
N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 0.87, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]-6-oxo-1H-pyrazine-3-carboxamide is sourced from PubChem (CID 56711357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).