2-azaspiro[4.4]non-7-ene-2-carboxamide

C9H14N2O — CID 90792234

IUPAC2-azaspiro[4.4]non-7-ene-2-carboxamide
SMILESNC(=O)N1CCC2(CC=CC2)C1
InChIInChI=1S/C9H14N2O/c10-8(12)11-6-5-9(7-11)3-1-2-4-9/h1-2H,3-7H2,(H2,10,12)
InChIKeyDURHYDDPYNGQNW-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.11
Rot. Bonds

About 2-azaspiro[4.4]non-7-ene-2-carboxamide

2-azaspiro[4.4]non-7-ene-2-carboxamide (PubChem CID 90792234) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 2-azaspiro[4.4]non-7-ene-2-carboxamide.

Molecular Properties

Compound Name2-azaspiro[4.4]non-7-ene-2-carboxamide
PubChem CID90792234
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name2-azaspiro[4.4]non-7-ene-2-carboxamide
SMILESNC(=O)N1CCC2(CC=CC2)C1
InChIInChI=1S/C9H14N2O/c10-8(12)11-6-5-9(7-11)3-1-2-4-9/h1-2H,3-7H2,(H2,10,12)
InChIKeyDURHYDDPYNGQNW-UHFFFAOYSA-N
XLogP1.11
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[4.4]non-7-ene-2-carboxamide?
The IUPAC name of 2-azaspiro[4.4]non-7-ene-2-carboxamide (CID 90792234) is 2-azaspiro[4.4]non-7-ene-2-carboxamide.
What is the SMILES notation for 2-azaspiro[4.4]non-7-ene-2-carboxamide?
The canonical SMILES for 2-azaspiro[4.4]non-7-ene-2-carboxamide is NC(=O)N1CCC2(CC=CC2)C1.
What is the InChIKey of 2-azaspiro[4.4]non-7-ene-2-carboxamide?
The InChIKey is DURHYDDPYNGQNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c10-8(12)11-6-5-9(7-11)3-1-2-4-9/h1-2H,3-7H2,(H2,10,12).
What are the key properties of 2-azaspiro[4.4]non-7-ene-2-carboxamide?
2-azaspiro[4.4]non-7-ene-2-carboxamide has a molecular weight of 166.22 g/mol, XLogP of 1.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azaspiro[4.4]non-7-ene-2-carboxamide is sourced from PubChem (CID 90792234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).