4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide

C20H32N2O2 — CID 155870207

IUPAC4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide
SMILESC=CCN1C(=O)CCC12CCC(NC(=O)C1CCC(C)CC1)CC2
InChIInChI=1S/C20H32N2O2/c1-3-14-22-18(23)10-13-20(22)11-8-17(9-12-20)21-19(24)16-6-4-15(2)5-7-16/h3,15-17H,1,4-14H2,2H3,(H,21,24)
InChIKeyYTJPUBPGDUAIHG-UHFFFAOYSA-N
MW332.49 g/mol
LogP3.42
Rot. Bonds4

About 4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide

4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide (PubChem CID 155870207) has the molecular formula C20H32N2O2 and a molecular weight of 332.49 g/mol. Its IUPAC name is 4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide
PubChem CID155870207
Molecular FormulaC20H32N2O2
Molecular Weight332.49 g/mol
Exact Mass332.25
IUPAC Name4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide
SMILESC=CCN1C(=O)CCC12CCC(NC(=O)C1CCC(C)CC1)CC2
InChIInChI=1S/C20H32N2O2/c1-3-14-22-18(23)10-13-20(22)11-8-17(9-12-20)21-19(24)16-6-4-15(2)5-7-16/h3,15-17H,1,4-14H2,2H3,(H,21,24)
InChIKeyYTJPUBPGDUAIHG-UHFFFAOYSA-N
XLogP3.42
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3,3-difluoro-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclobutane-1-carboxamide
CID 155870847
N-[(4-methylcyclohexyl)methyl]-2-(4-pyrrolidin-1-ylcyclohexyl)acetamide
CID 140567953
4-N-cyclohexyl-1-N-prop-2-enylcyclohexane-1,4-dicarboxamide
CID 109144848
1-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohex-3-ene-1-carboxamide
CID 155870100

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide?
The IUPAC name of 4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide (CID 155870207) is 4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide is C=CCN1C(=O)CCC12CCC(NC(=O)C1CCC(C)CC1)CC2.
What is the InChIKey of 4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide?
The InChIKey is YTJPUBPGDUAIHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O2/c1-3-14-22-18(23)10-13-20(22)11-8-17(9-12-20)21-19(24)16-6-4-15(2)5-7-16/h3,15-17H,1,4-14H2,2H3,(H,21,24).
What are the key properties of 4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide?
4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide has a molecular weight of 332.49 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-oxo-1-prop-2-enyl-1-azaspiro[4.5]decan-8-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 155870207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).