2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine

C10H18FNO — CID 112562774

IUPAC2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine
SMILESNCC(F)C1CCOC2(CCC2)C1
InChIInChI=1S/C10H18FNO/c11-9(7-12)8-2-5-13-10(6-8)3-1-4-10/h8-9H,1-7,12H2
InChIKeyRIGJFLPICSILHC-UHFFFAOYSA-N
MW187.26 g/mol
LogP1.63
Rot. Bonds2

About 2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine

2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine (PubChem CID 112562774) has the molecular formula C10H18FNO and a molecular weight of 187.26 g/mol. Its IUPAC name is 2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine.

Molecular Properties

Compound Name2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine
PubChem CID112562774
Molecular FormulaC10H18FNO
Molecular Weight187.26 g/mol
Exact Mass187.14
IUPAC Name2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine
SMILESNCC(F)C1CCOC2(CCC2)C1
InChIInChI=1S/C10H18FNO/c11-9(7-12)8-2-5-13-10(6-8)3-1-4-10/h8-9H,1-7,12H2
InChIKeyRIGJFLPICSILHC-UHFFFAOYSA-N
XLogP1.63
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Oxaspiro(3.5)nonan-8-ylmethanamine hydrochloride
CID 121552697
{5-Oxaspiro[3.5]nonan-6-yl}methanamine hydrochloride
CID 132300825
2-[6-Oxaspiro[4.5]decan-9-yl] ethylamine
CID 79920888
{5-Oxaspiro[3.5]nonan-8-yl}methanamine
CID 79905068
3,3,3-Trifluoro-1-(5-oxaspiro[3.5]nonan-8-yl)propan-1-amine
CID 79915272
4,4,4-Trifluoro-1-(5-oxaspiro[3.5]nonan-8-yl)butan-1-amine
CID 79953913
1-(5-Oxaspiro[3.5]nonan-8-yl)-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103148203
3-(2,2-Difluoroethoxy)-1-(5-oxaspiro[3.5]nonan-8-yl)propan-1-amine
CID 103149111
3,3,3-Trifluoro-1-(5-oxaspiro[3.5]nonan-8-yl)-2-(trifluoromethyl)propan-1-amine
CID 103312137
4-Fluoro-4-(methoxymethyl)-5-(oxan-4-yl)pentan-1-amine
CID 103392477
4-Fluoro-5-methoxy-4-(5-oxaspiro[3.5]nonan-8-yl)pentan-1-amine
CID 103392600
2,2-Difluoro-1-(5-oxaspiro[3.5]nonan-8-yl)ethanamine
CID 103516870

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine?
The IUPAC name of 2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine (CID 112562774) is 2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine.
What is the SMILES notation for 2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine?
The canonical SMILES for 2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine is NCC(F)C1CCOC2(CCC2)C1.
What is the InChIKey of 2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine?
The InChIKey is RIGJFLPICSILHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO/c11-9(7-12)8-2-5-13-10(6-8)3-1-4-10/h8-9H,1-7,12H2.
What are the key properties of 2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine?
2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine has a molecular weight of 187.26 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-(5-oxaspiro[3.5]nonan-8-yl)ethanamine is sourced from PubChem (CID 112562774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).