N-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide

C20H28N4O2 — CID 128993076

IUPACN-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide
SMILESCCn1ccnc1CN(C(=O)c1oc(C)cc1C)C1CC12CCNCC2
InChIInChI=1S/C20H28N4O2/c1-4-23-10-9-22-17(23)13-24(16-12-20(16)5-7-21-8-6-20)19(25)18-14(2)11-15(3)26-18/h9-11,16,21H,4-8,12-13H2,1-3H3
InChIKeyGRIANQONVLJXAE-UHFFFAOYSA-N
MW356.47 g/mol
LogP2.90
Rot. Bonds5

About N-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide

N-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide (PubChem CID 128993076) has the molecular formula C20H28N4O2 and a molecular weight of 356.47 g/mol. Its IUPAC name is N-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide
PubChem CID128993076
Molecular FormulaC20H28N4O2
Molecular Weight356.47 g/mol
Exact Mass356.22
IUPAC NameN-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide
SMILESCCn1ccnc1CN(C(=O)c1oc(C)cc1C)C1CC12CCNCC2
InChIInChI=1S/C20H28N4O2/c1-4-23-10-9-22-17(23)13-24(16-12-20(16)5-7-21-8-6-20)19(25)18-14(2)11-15(3)26-18/h9-11,16,21H,4-8,12-13H2,1-3H3
InChIKeyGRIANQONVLJXAE-UHFFFAOYSA-N
XLogP2.90
TPSA63.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-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-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide?
The IUPAC name of N-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide (CID 128993076) is N-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide.
What is the SMILES notation for N-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide?
The canonical SMILES for N-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide is CCn1ccnc1CN(C(=O)c1oc(C)cc1C)C1CC12CCNCC2.
What is the InChIKey of N-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide?
The InChIKey is GRIANQONVLJXAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O2/c1-4-23-10-9-22-17(23)13-24(16-12-20(16)5-7-21-8-6-20)19(25)18-14(2)11-15(3)26-18/h9-11,16,21H,4-8,12-13H2,1-3H3.
What are the key properties of N-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide?
N-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide has a molecular weight of 356.47 g/mol, XLogP of 2.90, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-azaspiro[2.5]octan-2-yl)-N-[(1-ethylimidazol-2-yl)methyl]-3,5-dimethylfuran-2-carboxamide is sourced from PubChem (CID 128993076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).