3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine

C10H18FNO2 — CID 139348943

IUPAC3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine
SMILESCC1(C)COC2(CC(N)C(F)C2)OC1
InChIInChI=1S/C10H18FNO2/c1-9(2)5-13-10(14-6-9)3-7(11)8(12)4-10/h7-8H,3-6,12H2,1-2H3
InChIKeyFCFRHHXXEMRZSP-UHFFFAOYSA-N
MW203.26 g/mol
LogP1.21
Rot. Bonds

About 3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine

3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine (PubChem CID 139348943) has the molecular formula C10H18FNO2 and a molecular weight of 203.26 g/mol. Its IUPAC name is 3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine.

Molecular Properties

Compound Name3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine
PubChem CID139348943
Molecular FormulaC10H18FNO2
Molecular Weight203.26 g/mol
Exact Mass203.13
IUPAC Name3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine
SMILESCC1(C)COC2(CC(N)C(F)C2)OC1
InChIInChI=1S/C10H18FNO2/c1-9(2)5-13-10(14-6-9)3-7(11)8(12)4-10/h7-8H,3-6,12H2,1-2H3
InChIKeyFCFRHHXXEMRZSP-UHFFFAOYSA-N
XLogP1.21
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.26
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5,5-dimethylspiro[1,3-dioxane-2,2'-3,3a,4,6a-tetrahydro-1H-pentalene]
CID 13247528
5',5'-dimethyl-5-methylidenespiro[1,3,3a,4,6,6a-hexahydropentalene-2,2'-1,3-dioxane]
CID 14287443
(5,5-dimethylspiro[1,3-dioxane-2,5'-2,3,3a,4,6,6a-hexahydro-1H-pentalene]-2'-yl)methanol
CID 154663039
(3'aR,6'aS)-5,5-dimethyl-2'-sulfanyloxyspiro[1,3-dioxane-2,5'-2,3,3a,4,6,6a-hexahydro-1H-pentalene]
CID 167097543
3,3-dimethyl-1,5,8,10-tetraoxaspiro[5.5]undecane
CID 89099466
(2S,3S)-2,3,8,8-tetramethyl-3-[(E)-prop-1-enyl]-6,10-dioxaspiro[4.5]decane
CID 101234485
(3S)-3-ethyl-8,8-dimethyl-6,10-dioxaspiro[4.5]decane
CID 58990308
[(3'aR,6'aS)-5,5-dimethylspiro[1,3-dioxane-2,5'-2,3,3a,4,6,6a-hexahydro-1H-pentalene]-2'-yl]-carboxycarbamic acid
CID 155231261
[(8S,10R)-8-(hydroxymethyl)-3,3-dimethyl-1,5,9-trioxaspiro[5.5]undecan-10-yl]methyl acetate
CID 10880728
2,2-diethyl-5,5-dimethyl-1,3-dioxane
CID 15146979
(4,4,6,6-tetramethyloxepan-2-yl)methanamine
CID 146666846
cis-(1S,2S)-2-fluoro-3,3,5,5-tetramethylcyclohexan-1-amine
CID 125452257

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine?
The IUPAC name of 3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine (CID 139348943) is 3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine.
What is the SMILES notation for 3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine?
The canonical SMILES for 3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine is CC1(C)COC2(CC(N)C(F)C2)OC1.
What is the InChIKey of 3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine?
The InChIKey is FCFRHHXXEMRZSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO2/c1-9(2)5-13-10(14-6-9)3-7(11)8(12)4-10/h7-8H,3-6,12H2,1-2H3.
What are the key properties of 3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine?
3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine has a molecular weight of 203.26 g/mol, XLogP of 1.21, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-8,8-dimethyl-6,10-dioxaspiro[4.5]decan-2-amine is sourced from PubChem (CID 139348943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).