2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]

C12H20FN — CID 170421918

IUPAC2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]
SMILESCC(C)C12CCCN1CC1(CC1F)C2
InChIInChI=1S/C12H20FN/c1-9(2)12-4-3-5-14(12)8-11(7-12)6-10(11)13/h9-10H,3-8H2,1-2H3
InChIKeyIQDJLLYNZDGVTK-UHFFFAOYSA-N
MW197.30 g/mol
LogP2.61
Rot. Bonds1

About 2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]

2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane] (PubChem CID 170421918) has the molecular formula C12H20FN and a molecular weight of 197.30 g/mol. Its IUPAC name is 2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane].

Molecular Properties

Compound Name2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]
PubChem CID170421918
Molecular FormulaC12H20FN
Molecular Weight197.30 g/mol
Exact Mass197.16
IUPAC Name2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]
SMILESCC(C)C12CCCN1CC1(CC1F)C2
InChIInChI=1S/C12H20FN/c1-9(2)12-4-3-5-14(12)8-11(7-12)6-10(11)13/h9-10H,3-8H2,1-2H3
InChIKeyIQDJLLYNZDGVTK-UHFFFAOYSA-N
XLogP2.61
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane] with MolForge

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Related Compounds

CID 175625806
CID 175625806
3-fluoro-5-propan-2-yl-1-azabicyclo[3.2.0]heptane
CID 170421734
(2'S,6S,8R)-3,3-dideuterio-8-(1,1-dideuterio-2-methylpropyl)-2'-fluorospiro[1,2,5,7-tetrahydropyrrolizine-6,1'-cyclopropane]
CID 176776511
2-methoxy-8-propan-2-yl-1,2,3,5,6,7-hexahydropyrrolizine
CID 170689578
3-fluoro-6-propan-2-yl-1-azatricyclo[4.3.0.02,4]nonane
CID 176800760
2-fluoro-8-(1-methoxyethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 170771511
1-(1-propan-2-ylcyclopentyl)piperazine
CID 83818772
(6E)-6-(fluoromethylidene)-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine
CID 163614751
(2R,8S)-8-(1-ethoxyethyl)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizine;methane
CID 177009819
2-methyl-8a-propan-2-yl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a][1,4]azaphosphinine 2-oxide
CID 171590791
1-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)ethoxyphosphane;tungsten
CID 169041366
3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine
CID 165465526

Frequently Asked Questions

What is the IUPAC name of 2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]?
The IUPAC name of 2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane] (CID 170421918) is 2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane].
What is the SMILES notation for 2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]?
The canonical SMILES for 2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane] is CC(C)C12CCCN1CC1(CC1F)C2.
What is the InChIKey of 2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]?
The InChIKey is IQDJLLYNZDGVTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20FN/c1-9(2)12-4-3-5-14(12)8-11(7-12)6-10(11)13/h9-10H,3-8H2,1-2H3.
What are the key properties of 2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]?
2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane] has a molecular weight of 197.30 g/mol, XLogP of 2.61, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-fluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane] is sourced from PubChem (CID 170421918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).