ethane;2-fluoro-N-methylbenzamide

C10H14FNO — CID 178102327

IUPACethane;2-fluoro-N-methylbenzamide
SMILESCC.CNC(=O)c1ccccc1F
InChIInChI=1S/C8H8FNO.C2H6/c1-10-8(11)6-4-2-3-5-7(6)9;1-2/h2-5H,1H3,(H,10,11);1-2H3
InChIKeyUDQJXKQAYMBRKN-UHFFFAOYSA-N
MW183.23 g/mol
LogP2.21
Rot. Bonds1

About ethane;2-fluoro-N-methylbenzamide

ethane;2-fluoro-N-methylbenzamide (PubChem CID 178102327) has the molecular formula C10H14FNO and a molecular weight of 183.23 g/mol. Its IUPAC name is ethane;2-fluoro-N-methylbenzamide.

Molecular Properties

Compound Nameethane;2-fluoro-N-methylbenzamide
PubChem CID178102327
Molecular FormulaC10H14FNO
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Nameethane;2-fluoro-N-methylbenzamide
SMILESCC.CNC(=O)c1ccccc1F
InChIInChI=1S/C8H8FNO.C2H6/c1-10-8(11)6-4-2-3-5-7(6)9;1-2/h2-5H,1H3,(H,10,11);1-2H3
InChIKeyUDQJXKQAYMBRKN-UHFFFAOYSA-N
XLogP2.21
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-fluoro-N-methylbenzamide;hydrate
CID 141303255
ethane;2-fluoro-N-methylbenzamide;3-fluoro-N-methylbenzamide
CID 145062937
3-fluoro-N-methyl-2-sulfanylbenzamide
CID 175999607
ethane;2-fluorobenzoic acid
CID 91182768
2-fluoro-N-[2-(methylamino)-2-oxoethoxy]benzamide
CID 110495597
N-(2,5-dimethylpyrrol-1-yl)-2-fluorobenzamide
CID 43822402
N-[2-[(N,N'-dimethylcarbamimidoyl)amino]ethyl]-2-fluorobenzamide;hydroiodide
CID 110917981
1-[4-[(2-fluorobenzoyl)amino]phenyl]-N-methyl-2-oxopyridine-3-carboxamide
CID 53119471
2-fluoro-N-methylbenzenecarbothioamide
CID 83390122
2-fluoro-N-[2-[[2-(methylamino)acetyl]amino]ethyl]benzamide
CID 119742065
2-fluoro-N-(4-methylpentyl)benzamide
CID 60738338
N,2-dimethylbenzamide;trifluoroborane
CID 174957672

Frequently Asked Questions

What is the IUPAC name of ethane;2-fluoro-N-methylbenzamide?
The IUPAC name of ethane;2-fluoro-N-methylbenzamide (CID 178102327) is ethane;2-fluoro-N-methylbenzamide.
What is the SMILES notation for ethane;2-fluoro-N-methylbenzamide?
The canonical SMILES for ethane;2-fluoro-N-methylbenzamide is CC.CNC(=O)c1ccccc1F.
What is the InChIKey of ethane;2-fluoro-N-methylbenzamide?
The InChIKey is UDQJXKQAYMBRKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNO.C2H6/c1-10-8(11)6-4-2-3-5-7(6)9;1-2/h2-5H,1H3,(H,10,11);1-2H3.
What are the key properties of ethane;2-fluoro-N-methylbenzamide?
ethane;2-fluoro-N-methylbenzamide has a molecular weight of 183.23 g/mol, XLogP of 2.21, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-fluoro-N-methylbenzamide is sourced from PubChem (CID 178102327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).