5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde

C10H10F3NO2 — CID 62121588

IUPAC5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde
SMILESO=Cc1ccc(N(CC(F)(F)F)C2CC2)o1
InChIInChI=1S/C10H10F3NO2/c11-10(12,13)6-14(7-1-2-7)9-4-3-8(5-15)16-9/h3-5,7H,1-2,6H2
InChIKeyFFLRXIBVBQLVBC-UHFFFAOYSA-N
MW233.19 g/mol
LogP2.62
Rot. Bonds4

About 5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde

5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde (PubChem CID 62121588) has the molecular formula C10H10F3NO2 and a molecular weight of 233.19 g/mol. Its IUPAC name is 5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde.

Molecular Properties

Compound Name5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde
PubChem CID62121588
Molecular FormulaC10H10F3NO2
Molecular Weight233.19 g/mol
Exact Mass233.07
IUPAC Name5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde
SMILESO=Cc1ccc(N(CC(F)(F)F)C2CC2)o1
InChIInChI=1S/C10H10F3NO2/c11-10(12,13)6-14(7-1-2-7)9-4-3-8(5-15)16-9/h3-5,7H,1-2,6H2
InChIKeyFFLRXIBVBQLVBC-UHFFFAOYSA-N
XLogP2.62
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.19
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde?
The IUPAC name of 5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde (CID 62121588) is 5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde.
What is the SMILES notation for 5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde?
The canonical SMILES for 5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde is O=Cc1ccc(N(CC(F)(F)F)C2CC2)o1.
What is the InChIKey of 5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde?
The InChIKey is FFLRXIBVBQLVBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO2/c11-10(12,13)6-14(7-1-2-7)9-4-3-8(5-15)16-9/h3-5,7H,1-2,6H2.
What are the key properties of 5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde?
5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde has a molecular weight of 233.19 g/mol, XLogP of 2.62, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[cyclopropyl(2,2,2-trifluoroethyl)amino]furan-2-carbaldehyde is sourced from PubChem (CID 62121588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).