N-ethyl-2-fluoro-N-(3-methylbutyl)benzamide

C14H20FNO — CID 91711943

IUPACN-ethyl-2-fluoro-N-(3-methylbutyl)benzamide
SMILESCCN(CCC(C)C)C(=O)c1ccccc1F
InChIInChI=1S/C14H20FNO/c1-4-16(10-9-11(2)3)14(17)12-7-5-6-8-13(12)15/h5-8,11H,4,9-10H2,1-3H3
InChIKeyLODRICGXFHKJBS-UHFFFAOYSA-N
MW237.32 g/mol
LogP3.33
Rot. Bonds5

About N-ethyl-2-fluoro-N-(3-methylbutyl)benzamide

N-ethyl-2-fluoro-N-(3-methylbutyl)benzamide (PubChem CID 91711943) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is N-ethyl-2-fluoro-N-(3-methylbutyl)benzamide.

Molecular Properties

Compound NameN-ethyl-2-fluoro-N-(3-methylbutyl)benzamide
PubChem CID91711943
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC NameN-ethyl-2-fluoro-N-(3-methylbutyl)benzamide
SMILESCCN(CCC(C)C)C(=O)c1ccccc1F
InChIInChI=1S/C14H20FNO/c1-4-16(10-9-11(2)3)14(17)12-7-5-6-8-13(12)15/h5-8,11H,4,9-10H2,1-3H3
InChIKeyLODRICGXFHKJBS-UHFFFAOYSA-N
XLogP3.33
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-diethyl-m-toluamide
CID 4284
N-Methylbenzamide
CID 11954
N,N-Diethyl-2-phenylacetamide
CID 17076
N,N-Diethylbenzamide
CID 15542
1-(4-Benzoyl-1-piperazinyl)-1-propanone
CID 4223812
Benzoylpiperidine
CID 69892
2-Methyl-N,N-diethylbenzamide
CID 75945
N-Propylbenzamide
CID 25354
1-(3,4-Difluorobenzoyl)-4-methylpiperazine
CID 550711
Amylase
CID 71475145
N-Ethylbenzamide
CID 11959
N,N-Dimethylbenzamide
CID 11916

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-fluoro-N-(3-methylbutyl)benzamide?
The IUPAC name of N-ethyl-2-fluoro-N-(3-methylbutyl)benzamide (CID 91711943) is N-ethyl-2-fluoro-N-(3-methylbutyl)benzamide.
What is the SMILES notation for N-ethyl-2-fluoro-N-(3-methylbutyl)benzamide?
The canonical SMILES for N-ethyl-2-fluoro-N-(3-methylbutyl)benzamide is CCN(CCC(C)C)C(=O)c1ccccc1F.
What is the InChIKey of N-ethyl-2-fluoro-N-(3-methylbutyl)benzamide?
The InChIKey is LODRICGXFHKJBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-4-16(10-9-11(2)3)14(17)12-7-5-6-8-13(12)15/h5-8,11H,4,9-10H2,1-3H3.
What are the key properties of N-ethyl-2-fluoro-N-(3-methylbutyl)benzamide?
N-ethyl-2-fluoro-N-(3-methylbutyl)benzamide has a molecular weight of 237.32 g/mol, XLogP of 3.33, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-fluoro-N-(3-methylbutyl)benzamide is sourced from PubChem (CID 91711943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).