N-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide

C10H15F4NO2 — CID 103733263

IUPACN-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide
SMILESCCN(CC1CCOC1)C(=O)C(F)(F)C(F)F
InChIInChI=1S/C10H15F4NO2/c1-2-15(5-7-3-4-17-6-7)9(16)10(13,14)8(11)12/h7-8H,2-6H2,1H3
InChIKeyBXMAIYIIKSLMPV-UHFFFAOYSA-N
MW257.23 g/mol
LogP1.77
Rot. Bonds5

About N-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide

N-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide (PubChem CID 103733263) has the molecular formula C10H15F4NO2 and a molecular weight of 257.23 g/mol. Its IUPAC name is N-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide.

Molecular Properties

Compound NameN-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide
PubChem CID103733263
Molecular FormulaC10H15F4NO2
Molecular Weight257.23 g/mol
Exact Mass257.10
IUPAC NameN-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide
SMILESCCN(CC1CCOC1)C(=O)C(F)(F)C(F)F
InChIInChI=1S/C10H15F4NO2/c1-2-15(5-7-3-4-17-6-7)9(16)10(13,14)8(11)12/h7-8H,2-6H2,1H3
InChIKeyBXMAIYIIKSLMPV-UHFFFAOYSA-N
XLogP1.77
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.23
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide 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-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide?
The IUPAC name of N-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide (CID 103733263) is N-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide.
What is the SMILES notation for N-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide?
The canonical SMILES for N-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide is CCN(CC1CCOC1)C(=O)C(F)(F)C(F)F.
What is the InChIKey of N-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide?
The InChIKey is BXMAIYIIKSLMPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F4NO2/c1-2-15(5-7-3-4-17-6-7)9(16)10(13,14)8(11)12/h7-8H,2-6H2,1H3.
What are the key properties of N-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide?
N-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide has a molecular weight of 257.23 g/mol, XLogP of 1.77, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2,3,3-tetrafluoro-N-(oxolan-3-ylmethyl)propanamide is sourced from PubChem (CID 103733263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).