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

C8H8F3NO — CID 96855256

IUPAC1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine
SMILESNC1(c2ccc(C(F)(F)F)o2)CC1
InChIInChI=1S/C8H8F3NO/c9-8(10,11)6-2-1-5(13-6)7(12)3-4-7/h1-2H,3-4,12H2
InChIKeyJRIDNARRBQFMLA-UHFFFAOYSA-N
MW191.15 g/mol
LogP2.25
Rot. Bonds1

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

1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine (PubChem CID 96855256) has the molecular formula C8H8F3NO and a molecular weight of 191.15 g/mol. Its IUPAC name is 1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine
PubChem CID96855256
Molecular FormulaC8H8F3NO
Molecular Weight191.15 g/mol
Exact Mass191.06
IUPAC Name1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine
SMILESNC1(c2ccc(C(F)(F)F)o2)CC1
InChIInChI=1S/C8H8F3NO/c9-8(10,11)6-2-1-5(13-6)7(12)3-4-7/h1-2H,3-4,12H2
InChIKeyJRIDNARRBQFMLA-UHFFFAOYSA-N
XLogP2.25
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.15
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine?
The IUPAC name of 1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine (CID 96855256) is 1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine.
What is the SMILES notation for 1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine?
The canonical SMILES for 1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine is NC1(c2ccc(C(F)(F)F)o2)CC1.
What is the InChIKey of 1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine?
The InChIKey is JRIDNARRBQFMLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3NO/c9-8(10,11)6-2-1-5(13-6)7(12)3-4-7/h1-2H,3-4,12H2.
What are the key properties of 1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine?
1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine has a molecular weight of 191.15 g/mol, XLogP of 2.25, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(trifluoromethyl)furan-2-yl]cyclopropan-1-amine is sourced from PubChem (CID 96855256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).