N,N-diethyl-2-fluorobenzamide

C11H14FNO — CID 669199

IUPACN,N-diethyl-2-fluorobenzamide
SMILESCCN(CC)C(=O)c1ccccc1F
InChIInChI=1S/C11H14FNO/c1-3-13(4-2)11(14)9-7-5-6-8-10(9)12/h5-8H,3-4H2,1-2H3
InChIKeyIOVYXBLAGKVAGL-UHFFFAOYSA-N
MW195.24 g/mol
LogP2.31
Rot. Bonds3

About N,N-diethyl-2-fluorobenzamide

N,N-diethyl-2-fluorobenzamide (PubChem CID 669199) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is N,N-diethyl-2-fluorobenzamide.

Molecular Properties

Compound NameN,N-diethyl-2-fluorobenzamide
PubChem CID669199
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC NameN,N-diethyl-2-fluorobenzamide
SMILESCCN(CC)C(=O)c1ccccc1F
InChIInChI=1S/C11H14FNO/c1-3-13(4-2)11(14)9-7-5-6-8-10(9)12/h5-8H,3-4H2,1-2H3
InChIKeyIOVYXBLAGKVAGL-UHFFFAOYSA-N
XLogP2.31
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-fluorobenzamide?
The IUPAC name of N,N-diethyl-2-fluorobenzamide (CID 669199) is N,N-diethyl-2-fluorobenzamide.
What is the SMILES notation for N,N-diethyl-2-fluorobenzamide?
The canonical SMILES for N,N-diethyl-2-fluorobenzamide is CCN(CC)C(=O)c1ccccc1F.
What is the InChIKey of N,N-diethyl-2-fluorobenzamide?
The InChIKey is IOVYXBLAGKVAGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c1-3-13(4-2)11(14)9-7-5-6-8-10(9)12/h5-8H,3-4H2,1-2H3.
What are the key properties of N,N-diethyl-2-fluorobenzamide?
N,N-diethyl-2-fluorobenzamide has a molecular weight of 195.24 g/mol, XLogP of 2.31, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-fluorobenzamide is sourced from PubChem (CID 669199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).