(Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide

C10H10FNO — CID 143272339

IUPAC(Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide
SMILESC/C(=C/c1cccc(F)c1)C(N)=O
InChIInChI=1S/C10H10FNO/c1-7(10(12)13)5-8-3-2-4-9(11)6-8/h2-6H,1H3,(H2,12,13)/b7-5-
InChIKeyIRFLFOZZXOJMRH-ALCCZGGFSA-N
MW179.19 g/mol
LogP1.71
Rot. Bonds2

About (Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide

(Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide (PubChem CID 143272339) has the molecular formula C10H10FNO and a molecular weight of 179.19 g/mol. Its IUPAC name is (Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide.

Molecular Properties

Compound Name(Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide
PubChem CID143272339
Molecular FormulaC10H10FNO
Molecular Weight179.19 g/mol
Exact Mass179.07
IUPAC Name(Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide
SMILESC/C(=C/c1cccc(F)c1)C(N)=O
InChIInChI=1S/C10H10FNO/c1-7(10(12)13)5-8-3-2-4-9(11)6-8/h2-6H,1H3,(H2,12,13)/b7-5-
InChIKeyIRFLFOZZXOJMRH-ALCCZGGFSA-N
XLogP1.71
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.19
LogP ≤ 51.71
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)-3-(3-fluorophenyl)-2-methylprop-2-enoic acid
CID 131513172
(E)-2-methyl-3-(3-phenylphenyl)prop-2-enamide
CID 127034031
(E)-3-(3-methoxyphenyl)-2-methylprop-2-enamide
CID 5375231
1-fluoro-3-(2-nitroprop-1-enyl)benzene
CID 74315808
ethyl (2Z)-2-[(3-fluorophenyl)methylidene]-3-oxobutanoate
CID 5388615
1-fluoro-3-[(E)-2,3,3,3-tetrafluoroprop-1-enyl]benzene
CID 165485333
2-[[(E)-3-(3-fluorophenyl)-2-methylprop-2-enoyl]amino]benzoic acid
CID 23292097
ethyl (Z)-2-fluoro-3-(3-fluorophenyl)prop-2-enoate
CID 641319
(2Z)-2-[(3-fluorophenyl)methylidene]-3,3-dimethylbutanoic acid
CID 87902667
1-amino-1-(3-fluorophenyl)propan-2-one
CID 55295099
ethyl 3-(3-fluorophenyl)-2-formamidoprop-2-enoate
CID 91419249
3-(3-fluorophenyl)prop-2-enoate
CID 53448593

Frequently Asked Questions

What is the IUPAC name of (Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide?
The IUPAC name of (Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide (CID 143272339) is (Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide.
What is the SMILES notation for (Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide?
The canonical SMILES for (Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide is C/C(=C/c1cccc(F)c1)C(N)=O.
What is the InChIKey of (Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide?
The InChIKey is IRFLFOZZXOJMRH-ALCCZGGFSA-N. The full InChI is InChI=1S/C10H10FNO/c1-7(10(12)13)5-8-3-2-4-9(11)6-8/h2-6H,1H3,(H2,12,13)/b7-5-.
What are the key properties of (Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide?
(Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide has a molecular weight of 179.19 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(3-fluorophenyl)-2-methylprop-2-enamide is sourced from PubChem (CID 143272339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).