2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone

C16H28N2O — CID 128886921

IUPAC2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone
SMILESO=C(CC1CCCCC1)N1CCC2(CCCNC2)C1
InChIInChI=1S/C16H28N2O/c19-15(11-14-5-2-1-3-6-14)18-10-8-16(13-18)7-4-9-17-12-16/h14,17H,1-13H2
InChIKeyUMSFACOHLSUXRJ-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.56
Rot. Bonds2

About 2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone

2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone (PubChem CID 128886921) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone.

Molecular Properties

Compound Name2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone
PubChem CID128886921
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone
SMILESO=C(CC1CCCCC1)N1CCC2(CCCNC2)C1
InChIInChI=1S/C16H28N2O/c19-15(11-14-5-2-1-3-6-14)18-10-8-16(13-18)7-4-9-17-12-16/h14,17H,1-13H2
InChIKeyUMSFACOHLSUXRJ-UHFFFAOYSA-N
XLogP2.56
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone?
The IUPAC name of 2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone (CID 128886921) is 2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone.
What is the SMILES notation for 2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone?
The canonical SMILES for 2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone is O=C(CC1CCCCC1)N1CCC2(CCCNC2)C1.
What is the InChIKey of 2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone?
The InChIKey is UMSFACOHLSUXRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c19-15(11-14-5-2-1-3-6-14)18-10-8-16(13-18)7-4-9-17-12-16/h14,17H,1-13H2.
What are the key properties of 2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone?
2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone has a molecular weight of 264.41 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(2,9-diazaspiro[4.5]decan-2-yl)ethanone is sourced from PubChem (CID 128886921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).