4-(4-fluorophenyl)-N-methylbutanamide

C11H14FNO — CID 23512824

IUPAC4-(4-fluorophenyl)-N-methylbutanamide
SMILESCNC(=O)CCCc1ccc(F)cc1
InChIInChI=1S/C11H14FNO/c1-13-11(14)4-2-3-9-5-7-10(12)8-6-9/h5-8H,2-4H2,1H3,(H,13,14)
InChIKeyNWUAAFMWRRXEIE-UHFFFAOYSA-N
MW195.24 g/mol
LogP1.89
Rot. Bonds4

About 4-(4-fluorophenyl)-N-methylbutanamide

4-(4-fluorophenyl)-N-methylbutanamide (PubChem CID 23512824) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-N-methylbutanamide.

Molecular Properties

Compound Name4-(4-fluorophenyl)-N-methylbutanamide
PubChem CID23512824
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name4-(4-fluorophenyl)-N-methylbutanamide
SMILESCNC(=O)CCCc1ccc(F)cc1
InChIInChI=1S/C11H14FNO/c1-13-11(14)4-2-3-9-5-7-10(12)8-6-9/h5-8H,2-4H2,1H3,(H,13,14)
InChIKeyNWUAAFMWRRXEIE-UHFFFAOYSA-N
XLogP1.89
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-N-methylbutanamide?
The IUPAC name of 4-(4-fluorophenyl)-N-methylbutanamide (CID 23512824) is 4-(4-fluorophenyl)-N-methylbutanamide.
What is the SMILES notation for 4-(4-fluorophenyl)-N-methylbutanamide?
The canonical SMILES for 4-(4-fluorophenyl)-N-methylbutanamide is CNC(=O)CCCc1ccc(F)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-N-methylbutanamide?
The InChIKey is NWUAAFMWRRXEIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c1-13-11(14)4-2-3-9-5-7-10(12)8-6-9/h5-8H,2-4H2,1H3,(H,13,14).
What are the key properties of 4-(4-fluorophenyl)-N-methylbutanamide?
4-(4-fluorophenyl)-N-methylbutanamide has a molecular weight of 195.24 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-N-methylbutanamide is sourced from PubChem (CID 23512824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).