benzene-1,2-dicarboxamide;piperazine

C12H18N4O2 — CID 159137360

IUPACbenzene-1,2-dicarboxamide;piperazine
SMILESC1CNCCN1.NC(=O)c1ccccc1C(N)=O
InChIInChI=1S/C8H8N2O2.C4H10N2/c9-7(11)5-3-1-2-4-6(5)8(10)12;1-2-6-4-3-5-1/h1-4H,(H2,9,11)(H2,10,12);5-6H,1-4H2
InChIKeyKHQWPLUMQKQAMY-UHFFFAOYSA-N
MW250.30 g/mol
LogP-0.94
Rot. Bonds2

About benzene-1,2-dicarboxamide;piperazine

benzene-1,2-dicarboxamide;piperazine (PubChem CID 159137360) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is benzene-1,2-dicarboxamide;piperazine.

Molecular Properties

Compound Namebenzene-1,2-dicarboxamide;piperazine
PubChem CID159137360
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Namebenzene-1,2-dicarboxamide;piperazine
SMILESC1CNCCN1.NC(=O)c1ccccc1C(N)=O
InChIInChI=1S/C8H8N2O2.C4H10N2/c9-7(11)5-3-1-2-4-6(5)8(10)12;1-2-6-4-3-5-1/h1-4H,(H2,9,11)(H2,10,12);5-6H,1-4H2
InChIKeyKHQWPLUMQKQAMY-UHFFFAOYSA-N
XLogP-0.94
TPSA110.24 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 5-0.94
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

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benzene-1,2-dicarboxamide;hydrazine
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2-oxaldehydoylbenzamide
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2-iodobenzamide
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2-amino-3-[2-(2-amino-3-carbamoylphenyl)phenyl]benzamide
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Frequently Asked Questions

What is the IUPAC name of benzene-1,2-dicarboxamide;piperazine?
The IUPAC name of benzene-1,2-dicarboxamide;piperazine (CID 159137360) is benzene-1,2-dicarboxamide;piperazine.
What is the SMILES notation for benzene-1,2-dicarboxamide;piperazine?
The canonical SMILES for benzene-1,2-dicarboxamide;piperazine is C1CNCCN1.NC(=O)c1ccccc1C(N)=O.
What is the InChIKey of benzene-1,2-dicarboxamide;piperazine?
The InChIKey is KHQWPLUMQKQAMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2.C4H10N2/c9-7(11)5-3-1-2-4-6(5)8(10)12;1-2-6-4-3-5-1/h1-4H,(H2,9,11)(H2,10,12);5-6H,1-4H2.
What are the key properties of benzene-1,2-dicarboxamide;piperazine?
benzene-1,2-dicarboxamide;piperazine has a molecular weight of 250.30 g/mol, XLogP of -0.94, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for benzene-1,2-dicarboxamide;piperazine is sourced from PubChem (CID 159137360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).