N-(2-fluoroethyl)oxolan-3-amine

C6H12FNO — CID 80713592

IUPACN-(2-fluoroethyl)oxolan-3-amine
SMILESFCCNC1CCOC1
InChIInChI=1S/C6H12FNO/c7-2-3-8-6-1-4-9-5-6/h6,8H,1-5H2
InChIKeyZZTAJYKCAFQYEO-UHFFFAOYSA-N
MW133.17 g/mol
LogP0.33
Rot. Bonds3

About N-(2-fluoroethyl)oxolan-3-amine

N-(2-fluoroethyl)oxolan-3-amine (PubChem CID 80713592) has the molecular formula C6H12FNO and a molecular weight of 133.17 g/mol. Its IUPAC name is N-(2-fluoroethyl)oxolan-3-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)oxolan-3-amine
PubChem CID80713592
Molecular FormulaC6H12FNO
Molecular Weight133.17 g/mol
Exact Mass133.09
IUPAC NameN-(2-fluoroethyl)oxolan-3-amine
SMILESFCCNC1CCOC1
InChIInChI=1S/C6H12FNO/c7-2-3-8-6-1-4-9-5-6/h6,8H,1-5H2
InChIKeyZZTAJYKCAFQYEO-UHFFFAOYSA-N
XLogP0.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.17
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-fluoroethyl)oxolan-3-amine 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 N-(2-fluoroethyl)oxolan-3-amine?
The IUPAC name of N-(2-fluoroethyl)oxolan-3-amine (CID 80713592) is N-(2-fluoroethyl)oxolan-3-amine.
What is the SMILES notation for N-(2-fluoroethyl)oxolan-3-amine?
The canonical SMILES for N-(2-fluoroethyl)oxolan-3-amine is FCCNC1CCOC1.
What is the InChIKey of N-(2-fluoroethyl)oxolan-3-amine?
The InChIKey is ZZTAJYKCAFQYEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FNO/c7-2-3-8-6-1-4-9-5-6/h6,8H,1-5H2.
What are the key properties of N-(2-fluoroethyl)oxolan-3-amine?
N-(2-fluoroethyl)oxolan-3-amine has a molecular weight of 133.17 g/mol, XLogP of 0.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)oxolan-3-amine is sourced from PubChem (CID 80713592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).