N-(2-fluorophenyl)butanamide

C10H12FNO — CID 849021

IUPACN-(2-fluorophenyl)butanamide
SMILESCCCC(=O)Nc1ccccc1F
InChIInChI=1S/C10H12FNO/c1-2-5-10(13)12-9-7-4-3-6-8(9)11/h3-4,6-7H,2,5H2,1H3,(H,12,13)
InChIKeyGVVLLAXPIWLPHM-UHFFFAOYSA-N
MW181.21 g/mol
LogP2.56
Rot. Bonds3

About N-(2-fluorophenyl)butanamide

N-(2-fluorophenyl)butanamide (PubChem CID 849021) has the molecular formula C10H12FNO and a molecular weight of 181.21 g/mol. Its IUPAC name is N-(2-fluorophenyl)butanamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)butanamide
PubChem CID849021
Molecular FormulaC10H12FNO
Molecular Weight181.21 g/mol
Exact Mass181.09
IUPAC NameN-(2-fluorophenyl)butanamide
SMILESCCCC(=O)Nc1ccccc1F
InChIInChI=1S/C10H12FNO/c1-2-5-10(13)12-9-7-4-3-6-8(9)11/h3-4,6-7H,2,5H2,1H3,(H,12,13)
InChIKeyGVVLLAXPIWLPHM-UHFFFAOYSA-N
XLogP2.56
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-fluorophenyl)hexanamide
CID 3481165
4-(2-fluoroanilino)-4-oxobutanoic acid
CID 573893
N-[6-(2-fluoroanilino)pyridazin-3-yl]butanamide
CID 113047136
N-(2-fluorophenyl)-4-hydrazinyl-4-oxobutanamide
CID 91820804
ethane;N-(2-hydroxyphenyl)butanamide
CID 142538893
N-[2-(2-fluoroanilino)-2-oxoethyl]pentanamide
CID 42765949
N-(2-fluorophenyl)-2-iodoacetamide
CID 12611676
N-(2-fluorophenyl)-5-hydroxypentanamide
CID 79019059
benzyl-ethyl-[3-(2-fluoroanilino)-3-oxopropyl]azanium
CID 7027949
N-(2-bromophenyl)butanamide
CID 732405
N-(2-fluorophenyl)-N',N'-dipropylpropanediamide
CID 108952439
(2R)-2-bromo-N-[3-(2-fluoroanilino)-3-oxopropyl]pentanamide
CID 26584951

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)butanamide?
The IUPAC name of N-(2-fluorophenyl)butanamide (CID 849021) is N-(2-fluorophenyl)butanamide.
What is the SMILES notation for N-(2-fluorophenyl)butanamide?
The canonical SMILES for N-(2-fluorophenyl)butanamide is CCCC(=O)Nc1ccccc1F.
What is the InChIKey of N-(2-fluorophenyl)butanamide?
The InChIKey is GVVLLAXPIWLPHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO/c1-2-5-10(13)12-9-7-4-3-6-8(9)11/h3-4,6-7H,2,5H2,1H3,(H,12,13).
What are the key properties of N-(2-fluorophenyl)butanamide?
N-(2-fluorophenyl)butanamide has a molecular weight of 181.21 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)butanamide is sourced from PubChem (CID 849021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).