6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide

C17H20N6O3 — CID 123151120

IUPAC6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide
SMILESCOCC(=O)N1CCN(c2cncc(C(=O)Nc3ccccn3)n2)CC1
InChIInChI=1S/C17H20N6O3/c1-26-12-16(24)23-8-6-22(7-9-23)15-11-18-10-13(20-15)17(25)21-14-4-2-3-5-19-14/h2-5,10-11H,6-9,12H2,1H3,(H,19,21,25)
InChIKeyQSCZBDNXQYZFKU-UHFFFAOYSA-N
MW356.39 g/mol
LogP0.42
Rot. Bonds5

About 6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide

6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide (PubChem CID 123151120) has the molecular formula C17H20N6O3 and a molecular weight of 356.39 g/mol. Its IUPAC name is 6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide.

Molecular Properties

Compound Name6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide
PubChem CID123151120
Molecular FormulaC17H20N6O3
Molecular Weight356.39 g/mol
Exact Mass356.16
IUPAC Name6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide
SMILESCOCC(=O)N1CCN(c2cncc(C(=O)Nc3ccccn3)n2)CC1
InChIInChI=1S/C17H20N6O3/c1-26-12-16(24)23-8-6-22(7-9-23)15-11-18-10-13(20-15)17(25)21-14-4-2-3-5-19-14/h2-5,10-11H,6-9,12H2,1H3,(H,19,21,25)
InChIKeyQSCZBDNXQYZFKU-UHFFFAOYSA-N
XLogP0.42
TPSA100.55 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.39
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6-(4-acetylpiperazin-1-yl)-N-pyridin-2-ylpyrazine-2-carboxamide
CID 123957243
1-[4-[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]piperazin-1-yl]-2-methoxyethanone
CID 133283460
3-methyl-6-[4-(2-methylpropanoyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide;molecular hydrogen
CID 160595614
1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one
CID 18714915
2-(4-chlorophenoxy)-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
CID 719964
6-chloro-N-[1-(2-methoxyacetyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 106551335
2-methoxy-1-[4-[4-(4-pyridin-2-ylpiperazine-1-carbonyl)phenoxy]piperidin-1-yl]ethanone
CID 25280317
1-[4-[5-(2-fluorophenyl)-2-pyridinyl]piperazin-1-yl]-2-methoxyethanone
CID 141044306
2-(3-methoxypropylamino)-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
CID 108994093
2-benzhydryloxy-1-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]ethanone
CID 86958960
N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide
CID 42866695
3-amino-6-[4-(morpholine-4-carbonyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide
CID 66745239

Frequently Asked Questions

What is the IUPAC name of 6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide?
The IUPAC name of 6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide (CID 123151120) is 6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide.
What is the SMILES notation for 6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide?
The canonical SMILES for 6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide is COCC(=O)N1CCN(c2cncc(C(=O)Nc3ccccn3)n2)CC1.
What is the InChIKey of 6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide?
The InChIKey is QSCZBDNXQYZFKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N6O3/c1-26-12-16(24)23-8-6-22(7-9-23)15-11-18-10-13(20-15)17(25)21-14-4-2-3-5-19-14/h2-5,10-11H,6-9,12H2,1H3,(H,19,21,25).
What are the key properties of 6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide?
6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide has a molecular weight of 356.39 g/mol, XLogP of 0.42, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(2-methoxyacetyl)piperazin-1-yl]-N-pyridin-2-ylpyrazine-2-carboxamide is sourced from PubChem (CID 123151120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).