cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone

C16H28N2O2 — CID 118742302

IUPACcyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone
SMILESCN1CCOC2(CCCN(C(=O)C3CCCCC3)C2)C1
InChIInChI=1S/C16H28N2O2/c1-17-10-11-20-16(12-17)8-5-9-18(13-16)15(19)14-6-3-2-4-7-14/h14H,2-13H2,1H3
InChIKeyRDYYTHRDPFGJLS-UHFFFAOYSA-N
MW280.41 g/mol
LogP1.89
Rot. Bonds1

About cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone

cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone (PubChem CID 118742302) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone.

Molecular Properties

Compound Namecyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone
PubChem CID118742302
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC Namecyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone
SMILESCN1CCOC2(CCCN(C(=O)C3CCCCC3)C2)C1
InChIInChI=1S/C16H28N2O2/c1-17-10-11-20-16(12-17)8-5-9-18(13-16)15(19)14-6-3-2-4-7-14/h14H,2-13H2,1H3
InChIKeyRDYYTHRDPFGJLS-UHFFFAOYSA-N
XLogP1.89
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone?
The IUPAC name of cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone (CID 118742302) is cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone.
What is the SMILES notation for cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone?
The canonical SMILES for cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone is CN1CCOC2(CCCN(C(=O)C3CCCCC3)C2)C1.
What is the InChIKey of cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone?
The InChIKey is RDYYTHRDPFGJLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-17-10-11-20-16(12-17)8-5-9-18(13-16)15(19)14-6-3-2-4-7-14/h14H,2-13H2,1H3.
What are the key properties of cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone?
cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone has a molecular weight of 280.41 g/mol, XLogP of 1.89, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-(4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl)methanone is sourced from PubChem (CID 118742302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).