2-(fluoromethyl)-N-methylprop-2-enamide

C5H8FNO — CID 90023989

IUPAC2-(fluoromethyl)-N-methylprop-2-enamide
SMILESC=C(CF)C(=O)NC
InChIInChI=1S/C5H8FNO/c1-4(3-6)5(8)7-2/h1,3H2,2H3,(H,7,8)
InChIKeyGNMXVLRTDANUEA-UHFFFAOYSA-N
MW117.12 g/mol
LogP0.26
Rot. Bonds2

About 2-(fluoromethyl)-N-methylprop-2-enamide

2-(fluoromethyl)-N-methylprop-2-enamide (PubChem CID 90023989) has the molecular formula C5H8FNO and a molecular weight of 117.12 g/mol. Its IUPAC name is 2-(fluoromethyl)-N-methylprop-2-enamide.

Molecular Properties

Compound Name2-(fluoromethyl)-N-methylprop-2-enamide
PubChem CID90023989
Molecular FormulaC5H8FNO
Molecular Weight117.12 g/mol
Exact Mass117.06
IUPAC Name2-(fluoromethyl)-N-methylprop-2-enamide
SMILESC=C(CF)C(=O)NC
InChIInChI=1S/C5H8FNO/c1-4(3-6)5(8)7-2/h1,3H2,2H3,(H,7,8)
InChIKeyGNMXVLRTDANUEA-UHFFFAOYSA-N
XLogP0.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.12
LogP ≤ 50.26
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

azane;N-methyl-2-methylidenepentanamide
CID 174850650
5,5,5-trifluoro-N,4-dimethyl-2-methylidenepentanamide
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N,N'-di((113C)methyl)oxamide
CID 169438737
2-(fluoromethyl)prop-2-enoate
CID 18790386
N,2-dimethylprop-2-enamide;ethane
CID 142291054
N-methyl-2-[4-[3-(methylamino)-3-oxoprop-1-en-2-yl]phenyl]prop-2-enamide
CID 70360767
2-(fluoromethyl)prop-2-enoyl 2-(fluoromethyl)prop-2-enoate
CID 154338012
2-methyl-4-(methylcarbamoyl)pent-4-ene-1-sulfonic acid
CID 87234352
N-methyl-2-methylidene-N'-propylpropanediamide
CID 102186954
3-hydroxy-N-methyl-2-oxopropanamide
CID 88958947
N-methyl-2-methylidenepent-3-enamide
CID 123693857
butane;(2E)-N,2-dimethylpenta-2,4-dienamide
CID 143504833

Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-N-methylprop-2-enamide?
The IUPAC name of 2-(fluoromethyl)-N-methylprop-2-enamide (CID 90023989) is 2-(fluoromethyl)-N-methylprop-2-enamide.
What is the SMILES notation for 2-(fluoromethyl)-N-methylprop-2-enamide?
The canonical SMILES for 2-(fluoromethyl)-N-methylprop-2-enamide is C=C(CF)C(=O)NC.
What is the InChIKey of 2-(fluoromethyl)-N-methylprop-2-enamide?
The InChIKey is GNMXVLRTDANUEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8FNO/c1-4(3-6)5(8)7-2/h1,3H2,2H3,(H,7,8).
What are the key properties of 2-(fluoromethyl)-N-methylprop-2-enamide?
2-(fluoromethyl)-N-methylprop-2-enamide has a molecular weight of 117.12 g/mol, XLogP of 0.26, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-N-methylprop-2-enamide is sourced from PubChem (CID 90023989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).