2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide

C12H17FN2O — CID 61267029

IUPAC2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide
SMILESCC(NC(=O)C(C)(C)N)c1ccc(F)cc1
InChIInChI=1S/C12H17FN2O/c1-8(15-11(16)12(2,3)14)9-4-6-10(13)7-5-9/h4-8H,14H2,1-3H3,(H,15,16)
InChIKeyPICRWVYTZUSVQG-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.74
Rot. Bonds3

About 2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide

2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide (PubChem CID 61267029) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is 2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide
PubChem CID61267029
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC Name2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide
SMILESCC(NC(=O)C(C)(C)N)c1ccc(F)cc1
InChIInChI=1S/C12H17FN2O/c1-8(15-11(16)12(2,3)14)9-4-6-10(13)7-5-9/h4-8H,14H2,1-3H3,(H,15,16)
InChIKeyPICRWVYTZUSVQG-UHFFFAOYSA-N
XLogP1.74
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide 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-amino-2-cyclopropyl-N-[1-(4-fluorophenyl)ethyl]propanamide
CID 61248453
3-chloro-N-[(1S)-1-(4-fluorophenyl)ethyl]-2,2-dimethylpropanamide
CID 81348452
2-amino-2-methyl-N-[1-(4-propan-2-yloxyphenyl)ethyl]propanamide
CID 61264808
2,2-diethyl-N-[1-(4-fluorophenyl)ethyl]butanamide
CID 117062720
2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]propanamide
CID 81349591
tert-butyl N-[1-(4-fluorophenyl)ethyl]carbamate
CID 63787964
4-tert-butyl-N-[(1S)-1-(4-fluorophenyl)ethyl]benzamide
CID 95795806
2-amino-2-methyl-N-[(1S)-1-(3-methylphenyl)ethyl]propanamide
CID 81360390
2-amino-N-[(1S)-1-(4-bromophenyl)ethyl]-3,3,3-trifluoro-2-methylpropanamide
CID 81360069
2-(aminomethyl)-N-[(1S)-1-(4-fluorophenyl)ethyl]-4,4-dimethylpentanamide
CID 107472487
N'-[(1R)-1-(4-fluorophenyl)ethyl]-N-[(1R)-1-phenylethyl]oxamide
CID 30405081
3-amino-N-[1-(4-fluorophenyl)ethyl]propanamide
CID 61247716

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide?
The IUPAC name of 2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide (CID 61267029) is 2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide?
The canonical SMILES for 2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide is CC(NC(=O)C(C)(C)N)c1ccc(F)cc1.
What is the InChIKey of 2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide?
The InChIKey is PICRWVYTZUSVQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c1-8(15-11(16)12(2,3)14)9-4-6-10(13)7-5-9/h4-8H,14H2,1-3H3,(H,15,16).
What are the key properties of 2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide?
2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide has a molecular weight of 224.28 g/mol, XLogP of 1.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide is sourced from PubChem (CID 61267029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).