(6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane]

C12H19F2N — CID 164943185

IUPAC(6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane]
SMILESCC(C)C12CCCN1C[C@@]1(C2)CC1(F)F
InChIInChI=1S/C12H19F2N/c1-9(2)11-4-3-5-15(11)8-10(6-11)7-12(10,13)14/h9H,3-8H2,1-2H3/t10-,11?/m1/s1
InChIKeyRPWUOPVJYVGSRP-NFJWQWPMSA-N
MW215.29 g/mol
LogP2.91
Rot. Bonds1

About (6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane]

(6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane] (PubChem CID 164943185) has the molecular formula C12H19F2N and a molecular weight of 215.29 g/mol. Its IUPAC name is (6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane].

Molecular Properties

Compound Name(6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane]
PubChem CID164943185
Molecular FormulaC12H19F2N
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Name(6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane]
SMILESCC(C)C12CCCN1C[C@@]1(C2)CC1(F)F
InChIInChI=1S/C12H19F2N/c1-9(2)11-4-3-5-15(11)8-10(6-11)7-12(10,13)14/h9H,3-8H2,1-2H3/t10-,11?/m1/s1
InChIKeyRPWUOPVJYVGSRP-NFJWQWPMSA-N
XLogP2.91
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

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Related Compounds

8-(2,2-dimethylpropyl)-6-fluoro-6-methyl-2,3,5,7-tetrahydro-1H-pyrrolizine
CID 160649558
2,6-Difluoro-8-propan-2-yl-1,2,3,5,6,7-hexahydropyrrolizine
CID 163614746
6,6-difluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine
CID 163614747
7,7-difluoro-8-propan-2-yl-2,3,5,6-tetrahydro-1H-pyrrolizine
CID 163614748
6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine
CID 163619299
7,7-difluoro-8-(2-methylpropyl)-2,3,5,6-tetrahydro-1H-pyrrolizine
CID 163977861
8-(2,2-Dimethylpropyl)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizine
CID 164735301
(8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen
CID 164875874
(8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane]
CID 164875875
1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane]
CID 164875882
1',1'-Difluorospiro[1,2,3,5,7,8-hexahydropyrrolizine-6,2'-cyclopropane]
CID 164876001
3,3-Difluoro-1-propan-2-yl-6-azatricyclo[4.3.0.02,4]nonane
CID 164943374

Frequently Asked Questions

What is the IUPAC name of (6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane]?
The IUPAC name of (6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane] (CID 164943185) is (6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane].
What is the SMILES notation for (6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane]?
The canonical SMILES for (6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane] is CC(C)C12CCCN1C[C@@]1(C2)CC1(F)F.
What is the InChIKey of (6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane]?
The InChIKey is RPWUOPVJYVGSRP-NFJWQWPMSA-N. The full InChI is InChI=1S/C12H19F2N/c1-9(2)11-4-3-5-15(11)8-10(6-11)7-12(10,13)14/h9H,3-8H2,1-2H3/t10-,11?/m1/s1.
What are the key properties of (6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane]?
(6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane] has a molecular weight of 215.29 g/mol, XLogP of 2.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-1',1'-difluoro-8-propan-2-ylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane] is sourced from PubChem (CID 164943185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).