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

C7H10F3NO — CID 102653210

IUPAC1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoro-N-methylethanamine
SMILESCNC(C1=CCCO1)C(F)(F)F
InChIInChI=1S/C7H10F3NO/c1-11-6(7(8,9)10)5-3-2-4-12-5/h3,6,11H,2,4H2,1H3
InChIKeyCPWVJWMDWDPUAN-UHFFFAOYSA-N
MW181.16 g/mol
LogP1.44
Rot. Bonds2

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

1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoro-N-methylethanamine (PubChem CID 102653210) has the molecular formula C7H10F3NO and a molecular weight of 181.16 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoro-N-methylethanamine.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoro-N-methylethanamine
PubChem CID102653210
Molecular FormulaC7H10F3NO
Molecular Weight181.16 g/mol
Exact Mass181.07
IUPAC Name1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoro-N-methylethanamine
SMILESCNC(C1=CCCO1)C(F)(F)F
InChIInChI=1S/C7H10F3NO/c1-11-6(7(8,9)10)5-3-2-4-12-5/h3,6,11H,2,4H2,1H3
InChIKeyCPWVJWMDWDPUAN-UHFFFAOYSA-N
XLogP1.44
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.16
LogP ≤ 51.44
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)-2,2,2-trifluoro-N-methylethanamine?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoro-N-methylethanamine (CID 102653210) is 1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoro-N-methylethanamine.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoro-N-methylethanamine?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoro-N-methylethanamine is CNC(C1=CCCO1)C(F)(F)F.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoro-N-methylethanamine?
The InChIKey is CPWVJWMDWDPUAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F3NO/c1-11-6(7(8,9)10)5-3-2-4-12-5/h3,6,11H,2,4H2,1H3.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoro-N-methylethanamine?
1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoro-N-methylethanamine has a molecular weight of 181.16 g/mol, XLogP of 1.44, 2 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)-2,2,2-trifluoro-N-methylethanamine is sourced from PubChem (CID 102653210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).