3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide

C20H21N5O2 — CID 118772615

IUPAC3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide
SMILESCOc1nccnc1-c1cccc(C(=O)N(C)C(C)Cc2cnccn2)c1
InChIInChI=1S/C20H21N5O2/c1-14(11-17-13-21-7-8-22-17)25(2)20(26)16-6-4-5-15(12-16)18-19(27-3)24-10-9-23-18/h4-10,12-14H,11H2,1-3H3
InChIKeyXBFOPFGYNDOFGX-UHFFFAOYSA-N
MW363.42 g/mol
LogP2.65
Rot. Bonds6

About 3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide

3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide (PubChem CID 118772615) has the molecular formula C20H21N5O2 and a molecular weight of 363.42 g/mol. Its IUPAC name is 3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide.

Molecular Properties

Compound Name3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide
PubChem CID118772615
Molecular FormulaC20H21N5O2
Molecular Weight363.42 g/mol
Exact Mass363.17
IUPAC Name3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide
SMILESCOc1nccnc1-c1cccc(C(=O)N(C)C(C)Cc2cnccn2)c1
InChIInChI=1S/C20H21N5O2/c1-14(11-17-13-21-7-8-22-17)25(2)20(26)16-6-4-5-15(12-16)18-19(27-3)24-10-9-23-18/h4-10,12-14H,11H2,1-3H3
InChIKeyXBFOPFGYNDOFGX-UHFFFAOYSA-N
XLogP2.65
TPSA81.10 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide?
The IUPAC name of 3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide (CID 118772615) is 3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide.
What is the SMILES notation for 3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide?
The canonical SMILES for 3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide is COc1nccnc1-c1cccc(C(=O)N(C)C(C)Cc2cnccn2)c1.
What is the InChIKey of 3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide?
The InChIKey is XBFOPFGYNDOFGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O2/c1-14(11-17-13-21-7-8-22-17)25(2)20(26)16-6-4-5-15(12-16)18-19(27-3)24-10-9-23-18/h4-10,12-14H,11H2,1-3H3.
What are the key properties of 3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide?
3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide has a molecular weight of 363.42 g/mol, XLogP of 2.65, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide is sourced from PubChem (CID 118772615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).