(2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide

C11H14FN3O2 — CID 119308751

IUPAC(2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide
SMILESC[C@@H](N)C(=O)NCC(=O)Nc1cccc(F)c1
InChIInChI=1S/C11H14FN3O2/c1-7(13)11(17)14-6-10(16)15-9-4-2-3-8(12)5-9/h2-5,7H,6,13H2,1H3,(H,14,17)(H,15,16)/t7-/m1/s1
InChIKeyFYSPRZVWROQGPE-SSDOTTSWSA-N
MW239.25 g/mol
LogP0.23
Rot. Bonds4

About (2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide

(2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide (PubChem CID 119308751) has the molecular formula C11H14FN3O2 and a molecular weight of 239.25 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide
PubChem CID119308751
Molecular FormulaC11H14FN3O2
Molecular Weight239.25 g/mol
Exact Mass239.11
IUPAC Name(2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide
SMILESC[C@@H](N)C(=O)NCC(=O)Nc1cccc(F)c1
InChIInChI=1S/C11H14FN3O2/c1-7(13)11(17)14-6-10(16)15-9-4-2-3-8(12)5-9/h2-5,7H,6,13H2,1H3,(H,14,17)(H,15,16)/t7-/m1/s1
InChIKeyFYSPRZVWROQGPE-SSDOTTSWSA-N
XLogP0.23
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.25
LogP ≤ 50.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-[2-(3-ethylanilino)-2-oxoethyl]propanamide
CID 119312061
N-[2-(3-fluoroanilino)-2-oxoethyl]-2-hydroxy-2-phenylacetamide
CID 111537513
N-(3-fluorophenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide
CID 772239
2-(3,3-dimethylbutan-2-ylamino)-N-(3-fluorophenyl)acetamide
CID 115626967
N-[2-(3-fluoroanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide
CID 49335487
N-ethyl-2-[[2-(3-fluoroanilino)-2-oxoethyl]amino]acetamide
CID 43401714
N-(3-fluorophenyl)-2-(2-methylpentan-3-ylamino)acetamide
CID 54954669
N-(3-fluorophenyl)-2-(2-methylbutylamino)acetamide
CID 55108758
N-(3-fluorophenyl)-2-(1-phenylethylamino)acetamide
CID 43179330
(2R)-2-amino-N-[2-(2,6-dimethylanilino)-2-oxoethyl]propanamide;hydrochloride
CID 119268629
2-amino-N-[(3-fluorophenyl)methyl]propanamide
CID 43123316
2-[(4-ethylphenyl)carbamoylamino]-N-(3-fluorophenyl)acetamide
CID 772260

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide (CID 119308751) is (2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide is C[C@@H](N)C(=O)NCC(=O)Nc1cccc(F)c1.
What is the InChIKey of (2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide?
The InChIKey is FYSPRZVWROQGPE-SSDOTTSWSA-N. The full InChI is InChI=1S/C11H14FN3O2/c1-7(13)11(17)14-6-10(16)15-9-4-2-3-8(12)5-9/h2-5,7H,6,13H2,1H3,(H,14,17)(H,15,16)/t7-/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide?
(2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide has a molecular weight of 239.25 g/mol, XLogP of 0.23, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-(3-fluoroanilino)-2-oxoethyl]propanamide is sourced from PubChem (CID 119308751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).