2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide

C10H16FNO — CID 130718770

IUPAC2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide
SMILESCC(C)(CF)NC(=O)C=C1CCC1
InChIInChI=1S/C10H16FNO/c1-10(2,7-11)12-9(13)6-8-4-3-5-8/h6H,3-5,7H2,1-2H3,(H,12,13)
InChIKeyYRKZTRIRHBLRBY-UHFFFAOYSA-N
MW185.24 g/mol
LogP1.96
Rot. Bonds3

About 2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide

2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide (PubChem CID 130718770) has the molecular formula C10H16FNO and a molecular weight of 185.24 g/mol. Its IUPAC name is 2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide
PubChem CID130718770
Molecular FormulaC10H16FNO
Molecular Weight185.24 g/mol
Exact Mass185.12
IUPAC Name2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide
SMILESCC(C)(CF)NC(=O)C=C1CCC1
InChIInChI=1S/C10H16FNO/c1-10(2,7-11)12-9(13)6-8-4-3-5-8/h6H,3-5,7H2,1-2H3,(H,12,13)
InChIKeyYRKZTRIRHBLRBY-UHFFFAOYSA-N
XLogP1.96
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.24
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(Z)-N-(tert-butyl)-3-ethyl-4-fluoropent-2-enamide
CID 177897438
(Z)-N-tert-butyl-4-methyl-3-(trifluoromethyl)pent-2-enamide
CID 89027815
(E)-N-tert-butyl-4-methyl-3-(trifluoromethyl)pent-2-enamide
CID 89037517
2-cyclobutylidene-N-(1-fluoropropan-2-yl)acetamide
CID 131175716
(Z)-N-tert-butyl-3,4-dimethylpent-2-enamide
CID 89027840
3-methyl-N-(2-methylbutan-2-yl)hex-2-enamide
CID 123303726
N-tert-butyl-2-cyclohexylideneacetamide
CID 127127224
(E)-N-tert-butylhex-2-enamide
CID 147155284
(2E,6Z)-N-tert-butylnona-2,6-dienamide
CID 11367800
(E)-N-tert-butyl-2-methylhex-2-enamide
CID 12616072
N-tert-butyl-2-cyclobutylideneacetamide
CID 130685902
2-cyclobutylidene-N-(2-methylbut-3-yn-2-yl)acetamide
CID 130748547

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide?
The IUPAC name of 2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide (CID 130718770) is 2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide.
What is the SMILES notation for 2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide?
The canonical SMILES for 2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide is CC(C)(CF)NC(=O)C=C1CCC1.
What is the InChIKey of 2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide?
The InChIKey is YRKZTRIRHBLRBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FNO/c1-10(2,7-11)12-9(13)6-8-4-3-5-8/h6H,3-5,7H2,1-2H3,(H,12,13).
What are the key properties of 2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide?
2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide has a molecular weight of 185.24 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutylidene-N-(1-fluoro-2-methylpropan-2-yl)acetamide is sourced from PubChem (CID 130718770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).