N-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide

C14H24FNO — CID 142543499

IUPACN-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide
SMILESC=C/C(=C\C)C[C@](C)(CC(C)(C)F)NC(C)=O
InChIInChI=1S/C14H24FNO/c1-7-12(8-2)9-14(6,16-11(3)17)10-13(4,5)15/h7-8H,1,9-10H2,2-6H3,(H,16,17)/b12-8+/t14-/m1/s1
InChIKeyWVSSHIYFDNLUFV-CEFACKQISA-N
MW241.35 g/mol
LogP3.54
Rot. Bonds6

About N-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide

N-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide (PubChem CID 142543499) has the molecular formula C14H24FNO and a molecular weight of 241.35 g/mol. Its IUPAC name is N-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide.

Molecular Properties

Compound NameN-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide
PubChem CID142543499
Molecular FormulaC14H24FNO
Molecular Weight241.35 g/mol
Exact Mass241.18
IUPAC NameN-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide
SMILESC=C/C(=C\C)C[C@](C)(CC(C)(C)F)NC(C)=O
InChIInChI=1S/C14H24FNO/c1-7-12(8-2)9-14(6,16-11(3)17)10-13(4,5)15/h7-8H,1,9-10H2,2-6H3,(H,16,17)/b12-8+/t14-/m1/s1
InChIKeyWVSSHIYFDNLUFV-CEFACKQISA-N
XLogP3.54
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.35
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide?
The IUPAC name of N-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide (CID 142543499) is N-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide.
What is the SMILES notation for N-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide?
The canonical SMILES for N-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide is C=C/C(=C\C)C[C@](C)(CC(C)(C)F)NC(C)=O.
What is the InChIKey of N-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide?
The InChIKey is WVSSHIYFDNLUFV-CEFACKQISA-N. The full InChI is InChI=1S/C14H24FNO/c1-7-12(8-2)9-14(6,16-11(3)17)10-13(4,5)15/h7-8H,1,9-10H2,2-6H3,(H,16,17)/b12-8+/t14-/m1/s1.
What are the key properties of N-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide?
N-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide has a molecular weight of 241.35 g/mol, XLogP of 3.54, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z,4R)-6-ethenyl-2-fluoro-2,4-dimethyloct-6-en-4-yl]acetamide is sourced from PubChem (CID 142543499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).