N-piperidin-1-ylhept-6-enamide

C12H22N2O — CID 163368544

IUPACN-piperidin-1-ylhept-6-enamide
SMILESC=CCCCCC(=O)NN1CCCCC1
InChIInChI=1S/C12H22N2O/c1-2-3-4-6-9-12(15)13-14-10-7-5-8-11-14/h2H,1,3-11H2,(H,13,15)
InChIKeyHCWUIBOLGNXCLP-UHFFFAOYSA-N
MW210.32 g/mol
LogP2.25
Rot. Bonds6

About N-piperidin-1-ylhept-6-enamide

N-piperidin-1-ylhept-6-enamide (PubChem CID 163368544) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is N-piperidin-1-ylhept-6-enamide.

Molecular Properties

Compound NameN-piperidin-1-ylhept-6-enamide
PubChem CID163368544
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC NameN-piperidin-1-ylhept-6-enamide
SMILESC=CCCCCC(=O)NN1CCCCC1
InChIInChI=1S/C12H22N2O/c1-2-3-4-6-9-12(15)13-14-10-7-5-8-11-14/h2H,1,3-11H2,(H,13,15)
InChIKeyHCWUIBOLGNXCLP-UHFFFAOYSA-N
XLogP2.25
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-piperidin-1-ylhept-6-enamide 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 N-piperidin-1-ylhept-6-enamide?
The IUPAC name of N-piperidin-1-ylhept-6-enamide (CID 163368544) is N-piperidin-1-ylhept-6-enamide.
What is the SMILES notation for N-piperidin-1-ylhept-6-enamide?
The canonical SMILES for N-piperidin-1-ylhept-6-enamide is C=CCCCCC(=O)NN1CCCCC1.
What is the InChIKey of N-piperidin-1-ylhept-6-enamide?
The InChIKey is HCWUIBOLGNXCLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-2-3-4-6-9-12(15)13-14-10-7-5-8-11-14/h2H,1,3-11H2,(H,13,15).
What are the key properties of N-piperidin-1-ylhept-6-enamide?
N-piperidin-1-ylhept-6-enamide has a molecular weight of 210.32 g/mol, XLogP of 2.25, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-1-ylhept-6-enamide is sourced from PubChem (CID 163368544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).