2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide

C10H12FNO2S — CID 174828930

IUPAC2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide
SMILESCON(C)C(=O)C1C(F)C1c1cccs1
InChIInChI=1S/C10H12FNO2S/c1-12(14-2)10(13)8-7(9(8)11)6-4-3-5-15-6/h3-5,7-9H,1-2H3
InChIKeyXCHOHKYWMZWZFE-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.82
Rot. Bonds3

About 2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide

2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide (PubChem CID 174828930) has the molecular formula C10H12FNO2S and a molecular weight of 229.28 g/mol. Its IUPAC name is 2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide
PubChem CID174828930
Molecular FormulaC10H12FNO2S
Molecular Weight229.28 g/mol
Exact Mass229.06
IUPAC Name2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide
SMILESCON(C)C(=O)C1C(F)C1c1cccs1
InChIInChI=1S/C10H12FNO2S/c1-12(14-2)10(13)8-7(9(8)11)6-4-3-5-15-6/h3-5,7-9H,1-2H3
InChIKeyXCHOHKYWMZWZFE-UHFFFAOYSA-N
XLogP1.82
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

(1S,2R,3R)-2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide
CID 134845661
(3S)-3-fluoro-N-methoxy-N-methyl-3-thiophen-3-ylpropanamide
CID 134959545
(3S)-3-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylpropanamide
CID 154713748
N-methoxy-N-methyl-2-(thiophen-2-yl)acetamide
CID 15029898
trans-(1R,2R)-N-methoxy-N-methyl-2-thiophen-2-ylcyclopropane-1-carboxamide
CID 15141052
N-hydroxy-N-[(2-thiophen-2-ylcyclopropyl)methyl]acetamide
CID 19894266
N-hydroxy-N-[1-(2-thiophen-2-ylcyclopropyl)ethyl]acetamide
CID 19894274
N-hydroxy-N-[[(1R,2R)-2-thiophen-2-ylcyclopropyl]methyl]acetamide
CID 22844510
2-Benzo[b]thiophen-3-yl-cyclopropanecarboxylic acid methoxy-methyl-amide
CID 23518976
N-hydroxy-N-[1-[(1R,2R)-2-thiophen-2-ylcyclopropyl]ethyl]acetamide
CID 54394926
N-hydroxy-5-thiophen-2-ylhexanamide
CID 56995961
N-hydroxy-N-[2-(2-thiophen-2-ylcyclopropyl)ethyl]acetamide
CID 57279146

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide?
The IUPAC name of 2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide (CID 174828930) is 2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide.
What is the SMILES notation for 2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide?
The canonical SMILES for 2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide is CON(C)C(=O)C1C(F)C1c1cccs1.
What is the InChIKey of 2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide?
The InChIKey is XCHOHKYWMZWZFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO2S/c1-12(14-2)10(13)8-7(9(8)11)6-4-3-5-15-6/h3-5,7-9H,1-2H3.
What are the key properties of 2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide?
2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide has a molecular weight of 229.28 g/mol, XLogP of 1.82, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-methoxy-N-methyl-3-thiophen-2-ylcyclopropane-1-carboxamide is sourced from PubChem (CID 174828930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).