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

C11H16F2N2O2 — CID 64881285

IUPAC1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESO=C1CNC(=O)C2(CCCCC2)N1CC(F)F
InChIInChI=1S/C11H16F2N2O2/c12-8(13)7-15-9(16)6-14-10(17)11(15)4-2-1-3-5-11/h8H,1-7H2,(H,14,17)
InChIKeyXGMVEOKMVDTULF-UHFFFAOYSA-N
MW246.26 g/mol
LogP0.91
Rot. Bonds2

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

1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione (PubChem CID 64881285) has the molecular formula C11H16F2N2O2 and a molecular weight of 246.26 g/mol. Its IUPAC name is 1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione.

Molecular Properties

Compound Name1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
PubChem CID64881285
Molecular FormulaC11H16F2N2O2
Molecular Weight246.26 g/mol
Exact Mass246.12
IUPAC Name1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESO=C1CNC(=O)C2(CCCCC2)N1CC(F)F
InChIInChI=1S/C11H16F2N2O2/c12-8(13)7-15-9(16)6-14-10(17)11(15)4-2-1-3-5-11/h8H,1-7H2,(H,14,17)
InChIKeyXGMVEOKMVDTULF-UHFFFAOYSA-N
XLogP0.91
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.26
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-Diazaspiro[5.5]undecane-3,5-dione
CID 7131553
1,4-Diazaspiro(5.5)undecan-5-one
CID 24217904
cyclohexyl-N-(2-oxo-2-piperidylethyl)carboxamide
CID 799930
2,2-Dimethyl-4-(propan-2-yl)-1,4-diazaspiro[5.5]undecan-5-one
CID 12580993
2,2-Dimethyl-4-propyl-1,4-diazaspiro[5.5]undecan-5-one
CID 134975948
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 56814163
N-[(2S)-1-amino-1-oxopropan-2-yl]-4,4-difluorocyclohexane-1-carboxamide
CID 75484149
(2S)-1-[2-[(2-cyclohexylacetyl)amino]acetyl]piperidine-2-carboxamide
CID 97315922
(3S)-3-(cyclohexylmethyl)-1-[2-(dimethylamino)ethyl]piperazine-2,5-dione
CID 131938554
(1S)-N-(2-amino-2-oxoethyl)-N-ethyl-3,3-difluorocyclohexane-1-carboxamide
CID 164643303
2-[2-Oxo-5-(3,3,3-trifluoropropyl)piperidin-1-yl]butanamide
CID 9878806
2-[5-(2,2-Difluoropropyl)-2-oxopiperidin-1-yl]butanamide
CID 9921437

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione?
The IUPAC name of 1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione (CID 64881285) is 1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione.
What is the SMILES notation for 1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione?
The canonical SMILES for 1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione is O=C1CNC(=O)C2(CCCCC2)N1CC(F)F.
What is the InChIKey of 1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione?
The InChIKey is XGMVEOKMVDTULF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F2N2O2/c12-8(13)7-15-9(16)6-14-10(17)11(15)4-2-1-3-5-11/h8H,1-7H2,(H,14,17).
What are the key properties of 1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione?
1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione has a molecular weight of 246.26 g/mol, XLogP of 0.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione is sourced from PubChem (CID 64881285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).