8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]

C11H18FN — CID 165123686

IUPAC8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]
SMILESCCC12CC(F)CN1CC1(CC1)C2
InChIInChI=1S/C11H18FN/c1-2-11-5-9(12)6-13(11)8-10(7-11)3-4-10/h9H,2-8H2,1H3
InChIKeyWNDVOIBOVYKEPY-UHFFFAOYSA-N
MW183.27 g/mol
LogP2.36
Rot. Bonds1

About 8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]

8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane] (PubChem CID 165123686) has the molecular formula C11H18FN and a molecular weight of 183.27 g/mol. Its IUPAC name is 8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane].

Molecular Properties

Compound Name8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]
PubChem CID165123686
Molecular FormulaC11H18FN
Molecular Weight183.27 g/mol
Exact Mass183.14
IUPAC Name8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]
SMILESCCC12CC(F)CN1CC1(CC1)C2
InChIInChI=1S/C11H18FN/c1-2-11-5-9(12)6-13(11)8-10(7-11)3-4-10/h9H,2-8H2,1H3
InChIKeyWNDVOIBOVYKEPY-UHFFFAOYSA-N
XLogP2.36
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.27
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]?
The IUPAC name of 8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane] (CID 165123686) is 8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane].
What is the SMILES notation for 8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]?
The canonical SMILES for 8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane] is CCC12CC(F)CN1CC1(CC1)C2.
What is the InChIKey of 8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]?
The InChIKey is WNDVOIBOVYKEPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18FN/c1-2-11-5-9(12)6-13(11)8-10(7-11)3-4-10/h9H,2-8H2,1H3.
What are the key properties of 8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]?
8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane] has a molecular weight of 183.27 g/mol, XLogP of 2.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-2-fluorospiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane] is sourced from PubChem (CID 165123686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).