4-(2-aminoethylidene)piperidine-1-carboxamide

C8H15N3O — CID 89384823

IUPAC4-(2-aminoethylidene)piperidine-1-carboxamide
SMILESNCC=C1CCN(C(N)=O)CC1
InChIInChI=1S/C8H15N3O/c9-4-1-7-2-5-11(6-3-7)8(10)12/h1H,2-6,9H2,(H2,10,12)
InChIKeySCFKERRCVVKJMT-UHFFFAOYSA-N
MW169.23 g/mol
LogP0.05
Rot. Bonds1

About 4-(2-aminoethylidene)piperidine-1-carboxamide

4-(2-aminoethylidene)piperidine-1-carboxamide (PubChem CID 89384823) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is 4-(2-aminoethylidene)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(2-aminoethylidene)piperidine-1-carboxamide
PubChem CID89384823
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name4-(2-aminoethylidene)piperidine-1-carboxamide
SMILESNCC=C1CCN(C(N)=O)CC1
InChIInChI=1S/C8H15N3O/c9-4-1-7-2-5-11(6-3-7)8(10)12/h1H,2-6,9H2,(H2,10,12)
InChIKeySCFKERRCVVKJMT-UHFFFAOYSA-N
XLogP0.05
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-(2-aminoethylidene)piperidine-1-carboxamide 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 4-(2-aminoethylidene)piperidine-1-carboxamide?
The IUPAC name of 4-(2-aminoethylidene)piperidine-1-carboxamide (CID 89384823) is 4-(2-aminoethylidene)piperidine-1-carboxamide.
What is the SMILES notation for 4-(2-aminoethylidene)piperidine-1-carboxamide?
The canonical SMILES for 4-(2-aminoethylidene)piperidine-1-carboxamide is NCC=C1CCN(C(N)=O)CC1.
What is the InChIKey of 4-(2-aminoethylidene)piperidine-1-carboxamide?
The InChIKey is SCFKERRCVVKJMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c9-4-1-7-2-5-11(6-3-7)8(10)12/h1H,2-6,9H2,(H2,10,12).
What are the key properties of 4-(2-aminoethylidene)piperidine-1-carboxamide?
4-(2-aminoethylidene)piperidine-1-carboxamide has a molecular weight of 169.23 g/mol, XLogP of 0.05, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoethylidene)piperidine-1-carboxamide is sourced from PubChem (CID 89384823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).