2-aminobenzamide;piperazine

C11H18N4O — CID 174878244

IUPAC2-aminobenzamide;piperazine
SMILESC1CNCCN1.NC(=O)c1ccccc1N
InChIInChI=1S/C7H8N2O.C4H10N2/c8-6-4-2-1-3-5(6)7(9)10;1-2-6-4-3-5-1/h1-4H,8H2,(H2,9,10);5-6H,1-4H2
InChIKeyZGOSIPKQKLCRPZ-UHFFFAOYSA-N
MW222.29 g/mol
LogP-0.45
Rot. Bonds1

About 2-aminobenzamide;piperazine

2-aminobenzamide;piperazine (PubChem CID 174878244) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-aminobenzamide;piperazine.

Molecular Properties

Compound Name2-aminobenzamide;piperazine
PubChem CID174878244
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name2-aminobenzamide;piperazine
SMILESC1CNCCN1.NC(=O)c1ccccc1N
InChIInChI=1S/C7H8N2O.C4H10N2/c8-6-4-2-1-3-5(6)7(9)10;1-2-6-4-3-5-1/h1-4H,8H2,(H2,9,10);5-6H,1-4H2
InChIKeyZGOSIPKQKLCRPZ-UHFFFAOYSA-N
XLogP-0.45
TPSA93.17 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 5-0.45
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

benzene-1,2-dicarboxamide;piperazine
CID 159137360
bis(2-aminobenzamide);platinum(2+)
CID 50912239
2-aminobenzamide;benzenecarbothioamide
CID 175524927
2-aminobenzamide;1H-pyridin-2-one
CID 68828870
2,3-diaminobenzamide;hydrochloride
CID 118989521
2,3-diaminobenzamide;dihydrochloride
CID 53422807
2-aminobenzamide;piperidine-1-carboxylic acid
CID 174784714
2-aminobenzoate
CID 5459842
benzene-1,2-diamine;2-carbamoylbenzoic acid
CID 175046115
benzene-1,2-dicarboxamide;hydrazine
CID 158131121
CID 67588186
CID 67588186
2-aminobenzoic acid;urea
CID 158027537

Frequently Asked Questions

What is the IUPAC name of 2-aminobenzamide;piperazine?
The IUPAC name of 2-aminobenzamide;piperazine (CID 174878244) is 2-aminobenzamide;piperazine.
What is the SMILES notation for 2-aminobenzamide;piperazine?
The canonical SMILES for 2-aminobenzamide;piperazine is C1CNCCN1.NC(=O)c1ccccc1N.
What is the InChIKey of 2-aminobenzamide;piperazine?
The InChIKey is ZGOSIPKQKLCRPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O.C4H10N2/c8-6-4-2-1-3-5(6)7(9)10;1-2-6-4-3-5-1/h1-4H,8H2,(H2,9,10);5-6H,1-4H2.
What are the key properties of 2-aminobenzamide;piperazine?
2-aminobenzamide;piperazine has a molecular weight of 222.29 g/mol, XLogP of -0.45, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminobenzamide;piperazine is sourced from PubChem (CID 174878244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).