N-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide

C8H10FNO — CID 143974056

IUPACN-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide
SMILESCC(=O)NC1=C(F)CCC=C1
InChIInChI=1S/C8H10FNO/c1-6(11)10-8-5-3-2-4-7(8)9/h3,5H,2,4H2,1H3,(H,10,11)
InChIKeySFPWOGKKLHRNBI-UHFFFAOYSA-N
MW155.17 g/mol
LogP1.65
Rot. Bonds1

About N-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide

N-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide (PubChem CID 143974056) has the molecular formula C8H10FNO and a molecular weight of 155.17 g/mol. Its IUPAC name is N-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide
PubChem CID143974056
Molecular FormulaC8H10FNO
Molecular Weight155.17 g/mol
Exact Mass155.07
IUPAC NameN-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide
SMILESCC(=O)NC1=C(F)CCC=C1
InChIInChI=1S/C8H10FNO/c1-6(11)10-8-5-3-2-4-7(8)9/h3,5H,2,4H2,1H3,(H,10,11)
InChIKeySFPWOGKKLHRNBI-UHFFFAOYSA-N
XLogP1.65
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.17
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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N-(1-cyclohexa-2,4-dien-1-ylideneethyl)-2,2,2-trifluoroacetamide
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6-(2-Fluoropropan-2-yl)pyridin-2-ol
CID 59928343
5-ethyl-6-(trifluoromethyl)-1H-pyridin-2-one
CID 68204646
(6E)-6-[(E)-2-fluorobut-2-enylidene]-5,5-dimethylpyridin-2-one
CID 89207139
N-(3-fluorocyclohexa-1,5-dien-1-yl)acetamide
CID 89363295
4-fluoro-6-propan-2-yl-1H-pyridin-2-one
CID 89973677
1-tert-butyl-6-fluoro-2H-isoquinolin-3-one
CID 90892190
4-fluoro-6-methyl-5-propan-2-yl-1H-pyridin-2-one
CID 122543524
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CID 122651083

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide?
The IUPAC name of N-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide (CID 143974056) is N-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide.
What is the SMILES notation for N-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide?
The canonical SMILES for N-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide is CC(=O)NC1=C(F)CCC=C1.
What is the InChIKey of N-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide?
The InChIKey is SFPWOGKKLHRNBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO/c1-6(11)10-8-5-3-2-4-7(8)9/h3,5H,2,4H2,1H3,(H,10,11).
What are the key properties of N-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide?
N-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide has a molecular weight of 155.17 g/mol, XLogP of 1.65, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorocyclohexa-1,5-dien-1-yl)acetamide is sourced from PubChem (CID 143974056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).