10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione

C13H21FN2O2 — CID 81110035

IUPAC10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione
SMILESCC1CC(=O)NC2(CCCC2)C(=O)N1CCCF
InChIInChI=1S/C13H21FN2O2/c1-10-9-11(17)15-13(5-2-3-6-13)12(18)16(10)8-4-7-14/h10H,2-9H2,1H3,(H,15,17)
InChIKeyVBZQSBKPVZEYQD-UHFFFAOYSA-N
MW256.32 g/mol
LogP1.40
Rot. Bonds3

About 10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione

10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione (PubChem CID 81110035) has the molecular formula C13H21FN2O2 and a molecular weight of 256.32 g/mol. Its IUPAC name is 10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione.

Molecular Properties

Compound Name10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione
PubChem CID81110035
Molecular FormulaC13H21FN2O2
Molecular Weight256.32 g/mol
Exact Mass256.16
IUPAC Name10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione
SMILESCC1CC(=O)NC2(CCCC2)C(=O)N1CCCF
InChIInChI=1S/C13H21FN2O2/c1-10-9-11(17)15-13(5-2-3-6-13)12(18)16(10)8-4-7-14/h10H,2-9H2,1H3,(H,15,17)
InChIKeyVBZQSBKPVZEYQD-UHFFFAOYSA-N
XLogP1.40
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.32
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione?
The IUPAC name of 10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione (CID 81110035) is 10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione.
What is the SMILES notation for 10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione?
The canonical SMILES for 10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione is CC1CC(=O)NC2(CCCC2)C(=O)N1CCCF.
What is the InChIKey of 10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione?
The InChIKey is VBZQSBKPVZEYQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21FN2O2/c1-10-9-11(17)15-13(5-2-3-6-13)12(18)16(10)8-4-7-14/h10H,2-9H2,1H3,(H,15,17).
What are the key properties of 10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione?
10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione has a molecular weight of 256.32 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione is sourced from PubChem (CID 81110035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).