2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine

C11H20FNO2 — CID 112565121

IUPAC2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine
SMILESCC(F)(CN)C1CCOC2(CCOC2)C1
InChIInChI=1S/C11H20FNO2/c1-10(12,7-13)9-2-4-15-11(6-9)3-5-14-8-11/h9H,2-8,13H2,1H3
InChIKeyUUIMUWJAEZUYDQ-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.26
Rot. Bonds2

About 2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine

2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine (PubChem CID 112565121) has the molecular formula C11H20FNO2 and a molecular weight of 217.28 g/mol. Its IUPAC name is 2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine.

Molecular Properties

Compound Name2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine
PubChem CID112565121
Molecular FormulaC11H20FNO2
Molecular Weight217.28 g/mol
Exact Mass217.15
IUPAC Name2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine
SMILESCC(F)(CN)C1CCOC2(CCOC2)C1
InChIInChI=1S/C11H20FNO2/c1-10(12,7-13)9-2-4-15-11(6-9)3-5-14-8-11/h9H,2-8,13H2,1H3
InChIKeyUUIMUWJAEZUYDQ-UHFFFAOYSA-N
XLogP1.26
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,6-dioxaspiro[4.5]decan-9-yl)-1-methoxypropan-2-amine
CID 79912770
4-(2,6-dioxaspiro[4.5]decan-9-yl)-4-methylpentan-2-one
CID 79923487
2-(1,9-dioxaspiro[5.5]undecan-4-yl)butan-2-amine
CID 79912977
4-(2,6-dioxaspiro[4.5]decan-9-yl)-2,6-dimethylheptan-4-ol
CID 114865417
1-(4-chlorophenyl)-1-(2,6-dioxaspiro[4.5]decan-9-yl)ethanamine
CID 79913330
9-methyl-2,6-dioxaspiro[4.5]decane
CID 177019737
1-(2,6-dioxaspiro[4.5]decan-9-yl)-1-(3-fluorophenyl)ethanol
CID 79900027
1-(4-chlorophenyl)-1-(2,6-dioxaspiro[4.5]decan-9-yl)ethanol
CID 79902291
2-amino-2-cyclopropyl-1-(2,6-dioxaspiro[4.5]decan-9-yl)propan-1-one
CID 116558477
3-methyl-3-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butan-1-amine
CID 81014334
2-(2,6-dioxaspiro[4.5]decan-9-yl)-4-(2-methoxyethylamino)butan-2-ol
CID 79908770
1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-ethyl-4,4,4-trifluorobutan-1-amine
CID 79953929

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine?
The IUPAC name of 2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine (CID 112565121) is 2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine.
What is the SMILES notation for 2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine?
The canonical SMILES for 2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine is CC(F)(CN)C1CCOC2(CCOC2)C1.
What is the InChIKey of 2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine?
The InChIKey is UUIMUWJAEZUYDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20FNO2/c1-10(12,7-13)9-2-4-15-11(6-9)3-5-14-8-11/h9H,2-8,13H2,1H3.
What are the key properties of 2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine?
2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine has a molecular weight of 217.28 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dioxaspiro[4.5]decan-9-yl)-2-fluoropropan-1-amine is sourced from PubChem (CID 112565121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).