2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine

C10H16FNO — CID 106640398

IUPAC2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine
SMILESFC(C1=CCCCO1)C1CCCN1
InChIInChI=1S/C10H16FNO/c11-10(8-4-3-6-12-8)9-5-1-2-7-13-9/h5,8,10,12H,1-4,6-7H2
InChIKeyBIMYBDIRYFYEJY-UHFFFAOYSA-N
MW185.24 g/mol
LogP1.77
Rot. Bonds2

About 2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine

2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine (PubChem CID 106640398) has the molecular formula C10H16FNO and a molecular weight of 185.24 g/mol. Its IUPAC name is 2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine.

Molecular Properties

Compound Name2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine
PubChem CID106640398
Molecular FormulaC10H16FNO
Molecular Weight185.24 g/mol
Exact Mass185.12
IUPAC Name2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine
SMILESFC(C1=CCCCO1)C1CCCN1
InChIInChI=1S/C10H16FNO/c11-10(8-4-3-6-12-8)9-5-1-2-7-13-9/h5,8,10,12H,1-4,6-7H2
InChIKeyBIMYBDIRYFYEJY-UHFFFAOYSA-N
XLogP1.77
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.24
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine?
The IUPAC name of 2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine (CID 106640398) is 2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine.
What is the SMILES notation for 2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine?
The canonical SMILES for 2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine is FC(C1=CCCCO1)C1CCCN1.
What is the InChIKey of 2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine?
The InChIKey is BIMYBDIRYFYEJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FNO/c11-10(8-4-3-6-12-8)9-5-1-2-7-13-9/h5,8,10,12H,1-4,6-7H2.
What are the key properties of 2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine?
2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine has a molecular weight of 185.24 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]pyrrolidine is sourced from PubChem (CID 106640398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).