2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine

C8H10F3NO — CID 82656590

IUPAC2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine
SMILESCC(CN)c1ccc(C(F)(F)F)o1
InChIInChI=1S/C8H10F3NO/c1-5(4-12)6-2-3-7(13-6)8(9,10)11/h2-3,5H,4,12H2,1H3
InChIKeyQVLBGEMYXRUUGJ-UHFFFAOYSA-N
MW193.17 g/mol
LogP2.36
Rot. Bonds2

About 2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine

2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine (PubChem CID 82656590) has the molecular formula C8H10F3NO and a molecular weight of 193.17 g/mol. Its IUPAC name is 2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine.

Molecular Properties

Compound Name2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine
PubChem CID82656590
Molecular FormulaC8H10F3NO
Molecular Weight193.17 g/mol
Exact Mass193.07
IUPAC Name2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine
SMILESCC(CN)c1ccc(C(F)(F)F)o1
InChIInChI=1S/C8H10F3NO/c1-5(4-12)6-2-3-7(13-6)8(9,10)11/h2-3,5H,4,12H2,1H3
InChIKeyQVLBGEMYXRUUGJ-UHFFFAOYSA-N
XLogP2.36
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.17
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine?
The IUPAC name of 2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine (CID 82656590) is 2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine.
What is the SMILES notation for 2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine?
The canonical SMILES for 2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine is CC(CN)c1ccc(C(F)(F)F)o1.
What is the InChIKey of 2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine?
The InChIKey is QVLBGEMYXRUUGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3NO/c1-5(4-12)6-2-3-7(13-6)8(9,10)11/h2-3,5H,4,12H2,1H3.
What are the key properties of 2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine?
2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine has a molecular weight of 193.17 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(trifluoromethyl)furan-2-yl]propan-1-amine is sourced from PubChem (CID 82656590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).