2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide

C9H16FNO2 — CID 126972955

IUPAC2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide
SMILESCC1(CNC(=O)C(C)(C)F)COC1
InChIInChI=1S/C9H16FNO2/c1-8(2,10)7(12)11-4-9(3)5-13-6-9/h4-6H2,1-3H3,(H,11,12)
InChIKeySQEDTIXBEKWQNV-UHFFFAOYSA-N
MW189.23 g/mol
LogP0.89
Rot. Bonds3

About 2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide

2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide (PubChem CID 126972955) has the molecular formula C9H16FNO2 and a molecular weight of 189.23 g/mol. Its IUPAC name is 2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide.

Molecular Properties

Compound Name2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide
PubChem CID126972955
Molecular FormulaC9H16FNO2
Molecular Weight189.23 g/mol
Exact Mass189.12
IUPAC Name2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide
SMILESCC1(CNC(=O)C(C)(C)F)COC1
InChIInChI=1S/C9H16FNO2/c1-8(2,10)7(12)11-4-9(3)5-13-6-9/h4-6H2,1-3H3,(H,11,12)
InChIKeySQEDTIXBEKWQNV-UHFFFAOYSA-N
XLogP0.89
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.23
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]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 2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide?
The IUPAC name of 2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide (CID 126972955) is 2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide.
What is the SMILES notation for 2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide?
The canonical SMILES for 2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide is CC1(CNC(=O)C(C)(C)F)COC1.
What is the InChIKey of 2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide?
The InChIKey is SQEDTIXBEKWQNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16FNO2/c1-8(2,10)7(12)11-4-9(3)5-13-6-9/h4-6H2,1-3H3,(H,11,12).
What are the key properties of 2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide?
2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide has a molecular weight of 189.23 g/mol, XLogP of 0.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide is sourced from PubChem (CID 126972955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).