9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one

C15H26N2O — CID 58653469

IUPAC9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one
SMILESCN1CCC2(CCCN(C3CCCCC3)C2)C1=O
InChIInChI=1S/C15H26N2O/c1-16-11-9-15(14(16)18)8-5-10-17(12-15)13-6-3-2-4-7-13/h13H,2-12H2,1H3
InChIKeyUBCCEKYBFDBLAP-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.26
Rot. Bonds1

About 9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one

9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one (PubChem CID 58653469) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one
PubChem CID58653469
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one
SMILESCN1CCC2(CCCN(C3CCCCC3)C2)C1=O
InChIInChI=1S/C15H26N2O/c1-16-11-9-15(14(16)18)8-5-10-17(12-15)13-6-3-2-4-7-13/h13H,2-12H2,1H3
InChIKeyUBCCEKYBFDBLAP-UHFFFAOYSA-N
XLogP2.26
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one?
The IUPAC name of 9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one (CID 58653469) is 9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for 9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one?
The canonical SMILES for 9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one is CN1CCC2(CCCN(C3CCCCC3)C2)C1=O.
What is the InChIKey of 9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one?
The InChIKey is UBCCEKYBFDBLAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-16-11-9-15(14(16)18)8-5-10-17(12-15)13-6-3-2-4-7-13/h13H,2-12H2,1H3.
What are the key properties of 9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one?
9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one has a molecular weight of 250.39 g/mol, XLogP of 2.26, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 58653469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).