7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane

C10H19FN2 — CID 170607685

IUPAC7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane
SMILESCC(C)(CF)N1CCNC2(CC2)C1
InChIInChI=1S/C10H19FN2/c1-9(2,7-11)13-6-5-12-10(8-13)3-4-10/h12H,3-8H2,1-2H3
InChIKeyYALUMCMIBVCGMA-UHFFFAOYSA-N
MW186.27 g/mol
LogP1.17
Rot. Bonds2

About 7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane

7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane (PubChem CID 170607685) has the molecular formula C10H19FN2 and a molecular weight of 186.27 g/mol. Its IUPAC name is 7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane.

Molecular Properties

Compound Name7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane
PubChem CID170607685
Molecular FormulaC10H19FN2
Molecular Weight186.27 g/mol
Exact Mass186.15
IUPAC Name7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane
SMILESCC(C)(CF)N1CCNC2(CC2)C1
InChIInChI=1S/C10H19FN2/c1-9(2,7-11)13-6-5-12-10(8-13)3-4-10/h12H,3-8H2,1-2H3
InChIKeyYALUMCMIBVCGMA-UHFFFAOYSA-N
XLogP1.17
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.27
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane?
The IUPAC name of 7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane (CID 170607685) is 7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane.
What is the SMILES notation for 7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane?
The canonical SMILES for 7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane is CC(C)(CF)N1CCNC2(CC2)C1.
What is the InChIKey of 7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane?
The InChIKey is YALUMCMIBVCGMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2/c1-9(2,7-11)13-6-5-12-10(8-13)3-4-10/h12H,3-8H2,1-2H3.
What are the key properties of 7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane?
7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane has a molecular weight of 186.27 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1-fluoro-2-methylpropan-2-yl)-4,7-diazaspiro[2.5]octane is sourced from PubChem (CID 170607685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).