2,3-diethylbenzamide;hydrofluoride

C11H16FNO — CID 175203586

IUPAC2,3-diethylbenzamide;hydrofluoride
SMILESCCc1cccc(C(N)=O)c1CC.F
InChIInChI=1S/C11H15NO.FH/c1-3-8-6-5-7-10(11(12)13)9(8)4-2;/h5-7H,3-4H2,1-2H3,(H2,12,13);1H
InChIKeyOWPRWBOTVZSYNC-UHFFFAOYSA-N
MW197.25 g/mol
LogP2.06
Rot. Bonds3

About 2,3-diethylbenzamide;hydrofluoride

2,3-diethylbenzamide;hydrofluoride (PubChem CID 175203586) has the molecular formula C11H16FNO and a molecular weight of 197.25 g/mol. Its IUPAC name is 2,3-diethylbenzamide;hydrofluoride.

Molecular Properties

Compound Name2,3-diethylbenzamide;hydrofluoride
PubChem CID175203586
Molecular FormulaC11H16FNO
Molecular Weight197.25 g/mol
Exact Mass197.12
IUPAC Name2,3-diethylbenzamide;hydrofluoride
SMILESCCc1cccc(C(N)=O)c1CC.F
InChIInChI=1S/C11H15NO.FH/c1-3-8-6-5-7-10(11(12)13)9(8)4-2;/h5-7H,3-4H2,1-2H3,(H2,12,13);1H
InChIKeyOWPRWBOTVZSYNC-UHFFFAOYSA-N
XLogP2.06
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.25
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 174785201
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2-(hydroxymethyl)benzene-1,3-dicarboxamide
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CID 174889008
3-ethyl-2-methylsulfonylbenzamide;hydrochloride
CID 122516953
2-ethyl-3-pentoxybenzamide
CID 67228177
2-ethyl-3-pyrimidin-5-ylbenzamide
CID 166652738
2,3-bis(2-methoxyethyl)benzamide
CID 140931342
2-methyl-3-propylbenzamide
CID 66693156
2-ethyl-3-(hydroxymethyl)benzoic acid
CID 141102852
N-[(E)-1-(2,3-diethylphenyl)ethylideneamino]-N-methylmethanamine
CID 172928171

Frequently Asked Questions

What is the IUPAC name of 2,3-diethylbenzamide;hydrofluoride?
The IUPAC name of 2,3-diethylbenzamide;hydrofluoride (CID 175203586) is 2,3-diethylbenzamide;hydrofluoride.
What is the SMILES notation for 2,3-diethylbenzamide;hydrofluoride?
The canonical SMILES for 2,3-diethylbenzamide;hydrofluoride is CCc1cccc(C(N)=O)c1CC.F.
What is the InChIKey of 2,3-diethylbenzamide;hydrofluoride?
The InChIKey is OWPRWBOTVZSYNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO.FH/c1-3-8-6-5-7-10(11(12)13)9(8)4-2;/h5-7H,3-4H2,1-2H3,(H2,12,13);1H.
What are the key properties of 2,3-diethylbenzamide;hydrofluoride?
2,3-diethylbenzamide;hydrofluoride has a molecular weight of 197.25 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diethylbenzamide;hydrofluoride is sourced from PubChem (CID 175203586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).