5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide

C22H40N2O — CID 155184685

IUPAC5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide
SMILESCCC(CC)CCNC(=O)C1CCN(CCCC2CCC2)CC12CC2
InChIInChI=1S/C22H40N2O/c1-3-18(4-2)10-14-23-21(25)20-11-16-24(17-22(20)12-13-22)15-6-9-19-7-5-8-19/h18-20H,3-17H2,1-2H3,(H,23,25)
InChIKeyFNAKHFGBHYWDCP-UHFFFAOYSA-N
MW348.58 g/mol
LogP4.61
Rot. Bonds10

About 5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide

5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide (PubChem CID 155184685) has the molecular formula C22H40N2O and a molecular weight of 348.58 g/mol. Its IUPAC name is 5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide.

Molecular Properties

Compound Name5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide
PubChem CID155184685
Molecular FormulaC22H40N2O
Molecular Weight348.58 g/mol
Exact Mass348.31
IUPAC Name5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide
SMILESCCC(CC)CCNC(=O)C1CCN(CCCC2CCC2)CC12CC2
InChIInChI=1S/C22H40N2O/c1-3-18(4-2)10-14-23-21(25)20-11-16-24(17-22(20)12-13-22)15-6-9-19-7-5-8-19/h18-20H,3-17H2,1-2H3,(H,23,25)
InChIKeyFNAKHFGBHYWDCP-UHFFFAOYSA-N
XLogP4.61
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.58
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide?
The IUPAC name of 5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide (CID 155184685) is 5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide.
What is the SMILES notation for 5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide?
The canonical SMILES for 5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide is CCC(CC)CCNC(=O)C1CCN(CCCC2CCC2)CC12CC2.
What is the InChIKey of 5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide?
The InChIKey is FNAKHFGBHYWDCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H40N2O/c1-3-18(4-2)10-14-23-21(25)20-11-16-24(17-22(20)12-13-22)15-6-9-19-7-5-8-19/h18-20H,3-17H2,1-2H3,(H,23,25).
What are the key properties of 5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide?
5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide has a molecular weight of 348.58 g/mol, XLogP of 4.61, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-cyclobutylpropyl)-N-(3-ethylpentyl)-5-azaspiro[2.5]octane-8-carboxamide is sourced from PubChem (CID 155184685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).