N-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide

C12H19N5O2 — CID 55167525

IUPACN-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide
SMILESCN(CCN1CCNCC1)C(=O)c1c[nH]c(=O)cn1
InChIInChI=1S/C12H19N5O2/c1-16(6-7-17-4-2-13-3-5-17)12(19)10-8-15-11(18)9-14-10/h8-9,13H,2-7H2,1H3,(H,15,18)
InChIKeyIEWZXKMCCDYNKV-UHFFFAOYSA-N
MW265.32 g/mol
LogP-1.25
Rot. Bonds4

About N-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide

N-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide (PubChem CID 55167525) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is N-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide
PubChem CID55167525
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC NameN-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide
SMILESCN(CCN1CCNCC1)C(=O)c1c[nH]c(=O)cn1
InChIInChI=1S/C12H19N5O2/c1-16(6-7-17-4-2-13-3-5-17)12(19)10-8-15-11(18)9-14-10/h8-9,13H,2-7H2,1H3,(H,15,18)
InChIKeyIEWZXKMCCDYNKV-UHFFFAOYSA-N
XLogP-1.25
TPSA81.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 5-1.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide?
The IUPAC name of N-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide (CID 55167525) is N-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide.
What is the SMILES notation for N-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide?
The canonical SMILES for N-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide is CN(CCN1CCNCC1)C(=O)c1c[nH]c(=O)cn1.
What is the InChIKey of N-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide?
The InChIKey is IEWZXKMCCDYNKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-16(6-7-17-4-2-13-3-5-17)12(19)10-8-15-11(18)9-14-10/h8-9,13H,2-7H2,1H3,(H,15,18).
What are the key properties of N-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide?
N-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide has a molecular weight of 265.32 g/mol, XLogP of -1.25, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazine-3-carboxamide is sourced from PubChem (CID 55167525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).