2-(1-aminopiperidin-4-yl)benzamide

C12H17N3O — CID 174916154

IUPAC2-(1-aminopiperidin-4-yl)benzamide
SMILESNC(=O)c1ccccc1C1CCN(N)CC1
InChIInChI=1S/C12H17N3O/c13-12(16)11-4-2-1-3-10(11)9-5-7-15(14)8-6-9/h1-4,9H,5-8,14H2,(H2,13,16)
InChIKeyJFBWFWHYIQXNII-UHFFFAOYSA-N
MW219.29 g/mol
LogP0.84
Rot. Bonds2

About 2-(1-aminopiperidin-4-yl)benzamide

2-(1-aminopiperidin-4-yl)benzamide (PubChem CID 174916154) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is 2-(1-aminopiperidin-4-yl)benzamide.

Molecular Properties

Compound Name2-(1-aminopiperidin-4-yl)benzamide
PubChem CID174916154
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name2-(1-aminopiperidin-4-yl)benzamide
SMILESNC(=O)c1ccccc1C1CCN(N)CC1
InChIInChI=1S/C12H17N3O/c13-12(16)11-4-2-1-3-10(11)9-5-7-15(14)8-6-9/h1-4,9H,5-8,14H2,(H2,13,16)
InChIKeyJFBWFWHYIQXNII-UHFFFAOYSA-N
XLogP0.84
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(1-aminopiperidin-4-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminopiperidin-4-yl)benzamide?
The IUPAC name of 2-(1-aminopiperidin-4-yl)benzamide (CID 174916154) is 2-(1-aminopiperidin-4-yl)benzamide.
What is the SMILES notation for 2-(1-aminopiperidin-4-yl)benzamide?
The canonical SMILES for 2-(1-aminopiperidin-4-yl)benzamide is NC(=O)c1ccccc1C1CCN(N)CC1.
What is the InChIKey of 2-(1-aminopiperidin-4-yl)benzamide?
The InChIKey is JFBWFWHYIQXNII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c13-12(16)11-4-2-1-3-10(11)9-5-7-15(14)8-6-9/h1-4,9H,5-8,14H2,(H2,13,16).
What are the key properties of 2-(1-aminopiperidin-4-yl)benzamide?
2-(1-aminopiperidin-4-yl)benzamide has a molecular weight of 219.29 g/mol, XLogP of 0.84, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminopiperidin-4-yl)benzamide is sourced from PubChem (CID 174916154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).