(2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide

C11H15FN2O — CID 61145838

IUPAC(2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide
SMILESC[C@H](N)C(=O)NCCc1cccc(F)c1
InChIInChI=1S/C11H15FN2O/c1-8(13)11(15)14-6-5-9-3-2-4-10(12)7-9/h2-4,7-8H,5-6,13H2,1H3,(H,14,15)/t8-/m0/s1
InChIKeyFOKCTQXJOUVAQS-QMMMGPOBSA-N
MW210.25 g/mol
LogP0.83
Rot. Bonds4

About (2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide

(2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide (PubChem CID 61145838) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is (2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide
PubChem CID61145838
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC Name(2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide
SMILESC[C@H](N)C(=O)NCCc1cccc(F)c1
InChIInChI=1S/C11H15FN2O/c1-8(13)11(15)14-6-5-9-3-2-4-10(12)7-9/h2-4,7-8H,5-6,13H2,1H3,(H,14,15)/t8-/m0/s1
InChIKeyFOKCTQXJOUVAQS-QMMMGPOBSA-N
XLogP0.83
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 ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide 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-N-[2-(3-fluorophenyl)ethyl]-3-methylbutanamide
CID 43566282
2-amino-N-[(3-fluorophenyl)methyl]propanamide
CID 43123316
2-amino-N-[2-(3-fluorophenyl)ethyl]-4-methylpentanamide
CID 43566283
2-amino-N-[2-(3-fluorophenyl)ethyl]-3-methylpentanamide
CID 43566279
(2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]butanamide;hydrochloride
CID 119273296
2-amino-N-[[4-[4-(3-fluorophenyl)butylamino]phenyl]methyl]propanamide
CID 67841783
5-amino-N-[2-(3-fluorophenyl)ethyl]hexanamide
CID 82849123
2-(3-fluorophenyl)ethylcarbamothioic S-acid
CID 115170336
1-[2-(3-fluorophenyl)ethyl]-3-(1-hydroxypropan-2-yl)urea
CID 110892882
2-[[(2R)-2-aminopropanoyl]amino]-3-(3-fluorophenyl)propanoic acid
CID 155171201
(2S)-2-(2-aminopropanoylamino)-3-(3-fluorophenyl)propanoic acid
CID 135362319
N-[2-(3-fluorophenyl)ethyl]-2-hydrazinyl-2-oxoacetamide
CID 43566530

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide?
The IUPAC name of (2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide (CID 61145838) is (2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide.
What is the SMILES notation for (2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide?
The canonical SMILES for (2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide is C[C@H](N)C(=O)NCCc1cccc(F)c1.
What is the InChIKey of (2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide?
The InChIKey is FOKCTQXJOUVAQS-QMMMGPOBSA-N. The full InChI is InChI=1S/C11H15FN2O/c1-8(13)11(15)14-6-5-9-3-2-4-10(12)7-9/h2-4,7-8H,5-6,13H2,1H3,(H,14,15)/t8-/m0/s1.
What are the key properties of (2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide?
(2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide has a molecular weight of 210.25 g/mol, XLogP of 0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-[2-(3-fluorophenyl)ethyl]propanamide is sourced from PubChem (CID 61145838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).