2-(3-fluorophenyl)-2-(methylamino)butanamide

C11H15FN2O — CID 114871926

IUPAC2-(3-fluorophenyl)-2-(methylamino)butanamide
SMILESCCC(NC)(C(N)=O)c1cccc(F)c1
InChIInChI=1S/C11H15FN2O/c1-3-11(14-2,10(13)15)8-5-4-6-9(12)7-8/h4-7,14H,3H2,1-2H3,(H2,13,15)
InChIKeyWPDGPADFGXGXPE-UHFFFAOYSA-N
MW210.25 g/mol
LogP1.14
Rot. Bonds4

About 2-(3-fluorophenyl)-2-(methylamino)butanamide

2-(3-fluorophenyl)-2-(methylamino)butanamide (PubChem CID 114871926) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-2-(methylamino)butanamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-2-(methylamino)butanamide
PubChem CID114871926
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC Name2-(3-fluorophenyl)-2-(methylamino)butanamide
SMILESCCC(NC)(C(N)=O)c1cccc(F)c1
InChIInChI=1S/C11H15FN2O/c1-3-11(14-2,10(13)15)8-5-4-6-9(12)7-8/h4-7,14H,3H2,1-2H3,(H2,13,15)
InChIKeyWPDGPADFGXGXPE-UHFFFAOYSA-N
XLogP1.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(3-fluorophenyl)-2-(methylamino)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-fluorophenyl)-2-(2-methoxyethylamino)butanamide
CID 114872011
2-(cycloheptylamino)-2-(3-fluorophenyl)butanamide
CID 114871995
3-(3-fluorophenyl)-3-(methylamino)pentanamide
CID 114873102
2-(3-azidopropylamino)-2-(3-fluorophenyl)butanamide
CID 114872028
2-(2-fluorophenyl)-2-(methylamino)butanamide
CID 112677135
ethyl 2-(cyclopentylamino)-2-(3-fluorophenyl)butanoate
CID 114871991
2-(benzylamino)-2-(3-fluorophenyl)butanoic acid
CID 114871957
2-(3-fluorophenyl)-2-(2-methylpropylamino)butanoic acid
CID 114871982
2-(2-fluoroanilino)-2-(3-fluorophenyl)butanoic acid
CID 114871976
2-(4-bromoanilino)-2-(3-fluorophenyl)butanoic acid
CID 114871972
2-(3-fluorophenyl)-2-hydroxypropanamide
CID 62213418
2-(3-chlorophenyl)-2-(ethylamino)butanamide
CID 60786890

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-2-(methylamino)butanamide?
The IUPAC name of 2-(3-fluorophenyl)-2-(methylamino)butanamide (CID 114871926) is 2-(3-fluorophenyl)-2-(methylamino)butanamide.
What is the SMILES notation for 2-(3-fluorophenyl)-2-(methylamino)butanamide?
The canonical SMILES for 2-(3-fluorophenyl)-2-(methylamino)butanamide is CCC(NC)(C(N)=O)c1cccc(F)c1.
What is the InChIKey of 2-(3-fluorophenyl)-2-(methylamino)butanamide?
The InChIKey is WPDGPADFGXGXPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c1-3-11(14-2,10(13)15)8-5-4-6-9(12)7-8/h4-7,14H,3H2,1-2H3,(H2,13,15).
What are the key properties of 2-(3-fluorophenyl)-2-(methylamino)butanamide?
2-(3-fluorophenyl)-2-(methylamino)butanamide has a molecular weight of 210.25 g/mol, XLogP of 1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-2-(methylamino)butanamide is sourced from PubChem (CID 114871926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).