2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane

C17H24F2N2 — CID 164923412

IUPAC2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane
SMILESFc1cc(F)cc(N2CCCC3(CCCNCCC3)C2)c1
InChIInChI=1S/C17H24F2N2/c18-14-10-15(19)12-16(11-14)21-9-3-6-17(13-21)4-1-7-20-8-2-5-17/h10-12,20H,1-9,13H2
InChIKeyLKEUMKLKUYOUFI-UHFFFAOYSA-N
MW294.39 g/mol
LogP3.71
Rot. Bonds1

About 2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane

2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane (PubChem CID 164923412) has the molecular formula C17H24F2N2 and a molecular weight of 294.39 g/mol. Its IUPAC name is 2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane.

Molecular Properties

Compound Name2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane
PubChem CID164923412
Molecular FormulaC17H24F2N2
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC Name2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane
SMILESFc1cc(F)cc(N2CCCC3(CCCNCCC3)C2)c1
InChIInChI=1S/C17H24F2N2/c18-14-10-15(19)12-16(11-14)21-9-3-6-17(13-21)4-1-7-20-8-2-5-17/h10-12,20H,1-9,13H2
InChIKeyLKEUMKLKUYOUFI-UHFFFAOYSA-N
XLogP3.71
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 18454792
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1-(3,5-difluorophenyl)piperidine
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2-(2,7-diazaspiro[4.5]decan-7-yl)-5-fluoroaniline
CID 89272054
4-(5-azaspiro[2.5]octan-5-yl)benzonitrile
CID 133480870
ethane;1-(4-fluorophenyl)-1,4-diazepane
CID 168950071
3-(azocan-1-yl)-5-fluorobenzonitrile
CID 102815222
2-[3-(1,4-diazepan-1-yl)-5-fluorophenoxy]-N,N-dimethylethanamine
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1-(3,5-difluorophenyl)-3-phenyl-1,4-diazepane
CID 64943123

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane?
The IUPAC name of 2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane (CID 164923412) is 2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane.
What is the SMILES notation for 2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane?
The canonical SMILES for 2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane is Fc1cc(F)cc(N2CCCC3(CCCNCCC3)C2)c1.
What is the InChIKey of 2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane?
The InChIKey is LKEUMKLKUYOUFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24F2N2/c18-14-10-15(19)12-16(11-14)21-9-3-6-17(13-21)4-1-7-20-8-2-5-17/h10-12,20H,1-9,13H2.
What are the key properties of 2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane?
2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane has a molecular weight of 294.39 g/mol, XLogP of 3.71, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluorophenyl)-2,10-diazaspiro[5.7]tridecane is sourced from PubChem (CID 164923412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).