(8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen

C10H17F2N — CID 164875874

IUPAC(8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen
SMILESC[C@@]12CCCN1CC1(CC1(F)F)C2.[H][H]
InChIInChI=1S/C10H15F2N.H2/c1-8-3-2-4-13(8)7-9(5-8)6-10(9,11)12;/h2-7H2,1H3;1H/t8-,9?;/m0./s1
InChIKeySRKHEIAOCSCZCM-GUORDYTPSA-N
MW189.25 g/mol
LogP2.52
Rot. Bonds

About (8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen

(8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen (PubChem CID 164875874) has the molecular formula C10H17F2N and a molecular weight of 189.25 g/mol. Its IUPAC name is (8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen.

Molecular Properties

Compound Name(8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen
PubChem CID164875874
Molecular FormulaC10H17F2N
Molecular Weight189.25 g/mol
Exact Mass189.13
IUPAC Name(8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen
SMILESC[C@@]12CCCN1CC1(CC1(F)F)C2.[H][H]
InChIInChI=1S/C10H15F2N.H2/c1-8-3-2-4-13(8)7-9(5-8)6-10(9,11)12;/h2-7H2,1H3;1H/t8-,9?;/m0./s1
InChIKeySRKHEIAOCSCZCM-GUORDYTPSA-N
XLogP2.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.25
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen with MolForge

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Frequently Asked Questions

What is the IUPAC name of (8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen?
The IUPAC name of (8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen (CID 164875874) is (8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen.
What is the SMILES notation for (8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen?
The canonical SMILES for (8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen is C[C@@]12CCCN1CC1(CC1(F)F)C2.[H][H].
What is the InChIKey of (8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen?
The InChIKey is SRKHEIAOCSCZCM-GUORDYTPSA-N. The full InChI is InChI=1S/C10H15F2N.H2/c1-8-3-2-4-13(8)7-9(5-8)6-10(9,11)12;/h2-7H2,1H3;1H/t8-,9?;/m0./s1.
What are the key properties of (8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen?
(8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen has a molecular weight of 189.25 g/mol, XLogP of 2.52, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (8S)-1',1'-difluoro-8-methylspiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane];molecular hydrogen is sourced from PubChem (CID 164875874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).