[2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine

C6H8F3NO — CID 154967933

IUPAC[2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine
SMILESNCC1=CCC(C(F)(F)F)O1
InChIInChI=1S/C6H8F3NO/c7-6(8,9)5-2-1-4(3-10)11-5/h1,5H,2-3,10H2
InChIKeyBRHCKAGDVNMXPH-UHFFFAOYSA-N
MW167.13 g/mol
LogP1.18
Rot. Bonds1

About [2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine

[2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine (PubChem CID 154967933) has the molecular formula C6H8F3NO and a molecular weight of 167.13 g/mol. Its IUPAC name is [2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine.

Molecular Properties

Compound Name[2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine
PubChem CID154967933
Molecular FormulaC6H8F3NO
Molecular Weight167.13 g/mol
Exact Mass167.06
IUPAC Name[2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine
SMILESNCC1=CCC(C(F)(F)F)O1
InChIInChI=1S/C6H8F3NO/c7-6(8,9)5-2-1-4(3-10)11-5/h1,5H,2-3,10H2
InChIKeyBRHCKAGDVNMXPH-UHFFFAOYSA-N
XLogP1.18
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.13
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine?
The IUPAC name of [2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine (CID 154967933) is [2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine.
What is the SMILES notation for [2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine?
The canonical SMILES for [2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine is NCC1=CCC(C(F)(F)F)O1.
What is the InChIKey of [2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine?
The InChIKey is BRHCKAGDVNMXPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F3NO/c7-6(8,9)5-2-1-4(3-10)11-5/h1,5H,2-3,10H2.
What are the key properties of [2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine?
[2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine has a molecular weight of 167.13 g/mol, XLogP of 1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(trifluoromethyl)-2,3-dihydrofuran-5-yl]methanamine is sourced from PubChem (CID 154967933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).