1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine

C7H11F2NO — CID 103517272

IUPAC1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine
SMILESCNC(C1=CCCO1)C(F)F
InChIInChI=1S/C7H11F2NO/c1-10-6(7(8)9)5-3-2-4-11-5/h3,6-7,10H,2,4H2,1H3
InChIKeyLIXHAEILDWUBRJ-UHFFFAOYSA-N
MW163.17 g/mol
LogP1.14
Rot. Bonds3

About 1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine

1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine (PubChem CID 103517272) has the molecular formula C7H11F2NO and a molecular weight of 163.17 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine
PubChem CID103517272
Molecular FormulaC7H11F2NO
Molecular Weight163.17 g/mol
Exact Mass163.08
IUPAC Name1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine
SMILESCNC(C1=CCCO1)C(F)F
InChIInChI=1S/C7H11F2NO/c1-10-6(7(8)9)5-3-2-4-11-5/h3,6-7,10H,2,4H2,1H3
InChIKeyLIXHAEILDWUBRJ-UHFFFAOYSA-N
XLogP1.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.17
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine (CID 103517272) is 1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine is CNC(C1=CCCO1)C(F)F.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine?
The InChIKey is LIXHAEILDWUBRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F2NO/c1-10-6(7(8)9)5-3-2-4-11-5/h3,6-7,10H,2,4H2,1H3.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine?
1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine has a molecular weight of 163.17 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-2,2-difluoro-N-methylethanamine is sourced from PubChem (CID 103517272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).