N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide

C15H26N2O — CID 13106462

IUPACN,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide
SMILESCCN(CC)C(=O)N1CCCC2(CC=CCC2)C1
InChIInChI=1S/C15H26N2O/c1-3-16(4-2)14(18)17-12-8-11-15(13-17)9-6-5-7-10-15/h5-6H,3-4,7-13H2,1-2H3
InChIKeyJAPRPTGJRYOKBI-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.27
Rot. Bonds2

About N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide

N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide (PubChem CID 13106462) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide
PubChem CID13106462
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide
SMILESCCN(CC)C(=O)N1CCCC2(CC=CCC2)C1
InChIInChI=1S/C15H26N2O/c1-3-16(4-2)14(18)17-12-8-11-15(13-17)9-6-5-7-10-15/h5-6H,3-4,7-13H2,1-2H3
InChIKeyJAPRPTGJRYOKBI-UHFFFAOYSA-N
XLogP3.27
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-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 N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide?
The IUPAC name of N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide (CID 13106462) is N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide.
What is the SMILES notation for N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide?
The canonical SMILES for N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide is CCN(CC)C(=O)N1CCCC2(CC=CCC2)C1.
What is the InChIKey of N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide?
The InChIKey is JAPRPTGJRYOKBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-3-16(4-2)14(18)17-12-8-11-15(13-17)9-6-5-7-10-15/h5-6H,3-4,7-13H2,1-2H3.
What are the key properties of N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide?
N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide has a molecular weight of 250.39 g/mol, XLogP of 3.27, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-azaspiro[5.5]undec-9-ene-2-carboxamide is sourced from PubChem (CID 13106462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).