4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione

C17H28N2O2 — CID 64970304

IUPAC4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCC1CCC(CN2CC(=O)NC3(CCCCC3)C2=O)CC1
InChIInChI=1S/C17H28N2O2/c1-13-5-7-14(8-6-13)11-19-12-15(20)18-17(16(19)21)9-3-2-4-10-17/h13-14H,2-12H2,1H3,(H,18,20)
InChIKeyTUFBLAZYGUIWCV-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.47
Rot. Bonds2

About 4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione

4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione (PubChem CID 64970304) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione.

Molecular Properties

Compound Name4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione
PubChem CID64970304
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCC1CCC(CN2CC(=O)NC3(CCCCC3)C2=O)CC1
InChIInChI=1S/C17H28N2O2/c1-13-5-7-14(8-6-13)11-19-12-15(20)18-17(16(19)21)9-3-2-4-10-17/h13-14H,2-12H2,1H3,(H,18,20)
InChIKeyTUFBLAZYGUIWCV-UHFFFAOYSA-N
XLogP2.47
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

9-(cyclobutylmethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64960256
4-(thiolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 107298582
3-[(4-methylcyclohexyl)methyl]-1,3-diazaspiro[4.4]nonan-4-one
CID 83254362
4-[(1-ethylpyrrolidin-3-yl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64963520
4-[(5-methyloxolan-2-yl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 103142003
9-[(1,1-dioxothiolan-3-yl)methyl]-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64969132
4-ethyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64879190
4-(oxan-2-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64878807
1-(cyclopropylmethyl)-3,3-diethylpiperazine-2,5-dione
CID 64882149
4-(2-propylsulfonylethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 106733699
4-(3-ethoxypropyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64958546
3-(cyclohexylmethyl)-8-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 7170081

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione?
The IUPAC name of 4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione (CID 64970304) is 4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione.
What is the SMILES notation for 4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione?
The canonical SMILES for 4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione is CC1CCC(CN2CC(=O)NC3(CCCCC3)C2=O)CC1.
What is the InChIKey of 4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione?
The InChIKey is TUFBLAZYGUIWCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-13-5-7-14(8-6-13)11-19-12-15(20)18-17(16(19)21)9-3-2-4-10-17/h13-14H,2-12H2,1H3,(H,18,20).
What are the key properties of 4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione?
4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione has a molecular weight of 292.42 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methylcyclohexyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione is sourced from PubChem (CID 64970304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).