(7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol

C11H17F2NO — CID 169193084

IUPAC(7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol
SMILESOCC12CC(F)(F)CCN1CC1(CC1)C2
InChIInChI=1S/C11H17F2NO/c12-11(13)3-4-14-7-9(1-2-9)5-10(14,6-11)8-15/h15H,1-8H2
InChIKeyQNYOVJSJTOUKRZ-UHFFFAOYSA-N
MW217.26 g/mol
LogP1.63
Rot. Bonds1

About (7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol

(7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol (PubChem CID 169193084) has the molecular formula C11H17F2NO and a molecular weight of 217.26 g/mol. Its IUPAC name is (7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol.

Molecular Properties

Compound Name(7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol
PubChem CID169193084
Molecular FormulaC11H17F2NO
Molecular Weight217.26 g/mol
Exact Mass217.13
IUPAC Name(7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol
SMILESOCC12CC(F)(F)CCN1CC1(CC1)C2
InChIInChI=1S/C11H17F2NO/c12-11(13)3-4-14-7-9(1-2-9)5-10(14,6-11)8-15/h15H,1-8H2
InChIKeyQNYOVJSJTOUKRZ-UHFFFAOYSA-N
XLogP1.63
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.26
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol?
The IUPAC name of (7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol (CID 169193084) is (7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol.
What is the SMILES notation for (7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol?
The canonical SMILES for (7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol is OCC12CC(F)(F)CCN1CC1(CC1)C2.
What is the InChIKey of (7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol?
The InChIKey is QNYOVJSJTOUKRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F2NO/c12-11(13)3-4-14-7-9(1-2-9)5-10(14,6-11)8-15/h15H,1-8H2.
What are the key properties of (7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol?
(7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol has a molecular weight of 217.26 g/mol, XLogP of 1.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7,7-difluorospiro[3,5,6,8-tetrahydro-1H-indolizine-2,1'-cyclopropane]-8a-yl)methanol is sourced from PubChem (CID 169193084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).