N-(4-fluorophenyl)-2-(propylamino)acetamide

C11H15FN2O — CID 28586343

IUPACN-(4-fluorophenyl)-2-(propylamino)acetamide
SMILESCCCNCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C11H15FN2O/c1-2-7-13-8-11(15)14-10-5-3-9(12)4-6-10/h3-6,13H,2,7-8H2,1H3,(H,14,15)
InChIKeyYBZJKDWZKLWEFT-UHFFFAOYSA-N
MW210.25 g/mol
LogP1.76
Rot. Bonds5

About N-(4-fluorophenyl)-2-(propylamino)acetamide

N-(4-fluorophenyl)-2-(propylamino)acetamide (PubChem CID 28586343) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-(propylamino)acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-(propylamino)acetamide
PubChem CID28586343
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC NameN-(4-fluorophenyl)-2-(propylamino)acetamide
SMILESCCCNCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C11H15FN2O/c1-2-7-13-8-11(15)14-10-5-3-9(12)4-6-10/h3-6,13H,2,7-8H2,1H3,(H,14,15)
InChIKeyYBZJKDWZKLWEFT-UHFFFAOYSA-N
XLogP1.76
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(4-fluorophenyl)-2-(pentylamino)acetamide
CID 28569105
N-(4-fluorophenyl)-2-(octylamino)acetamide
CID 78914389
N-[4-[[2-(propylamino)acetyl]amino]phenyl]propanamide
CID 54818859
2-(propylamino)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 60648393
N-[4-(diethylamino)phenyl]-2-(propylamino)acetamide
CID 60648364
N-(3-bromo-4-fluorophenyl)-2-(propylamino)acetamide
CID 104778142
N-(4-fluorophenyl)-2-(prop-2-ynylamino)acetamide
CID 28563124
N-ethyl-4-[[2-(propylamino)acetyl]amino]benzamide
CID 54818586
N-(4-fluorophenyl)-2-[2-(2-methylphenyl)ethylamino]acetamide
CID 78915505
N-(4-fluorophenyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]acetamide
CID 62642513
N-(4-fluorophenyl)-2-(2-hydroxypropylamino)acetamide
CID 43389711
N-[4-[[2-(4-fluoroanilino)-2-oxoethyl]amino]phenyl]butanamide
CID 54836956

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-(propylamino)acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-(propylamino)acetamide (CID 28586343) is N-(4-fluorophenyl)-2-(propylamino)acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-(propylamino)acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-(propylamino)acetamide is CCCNCC(=O)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-2-(propylamino)acetamide?
The InChIKey is YBZJKDWZKLWEFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c1-2-7-13-8-11(15)14-10-5-3-9(12)4-6-10/h3-6,13H,2,7-8H2,1H3,(H,14,15).
What are the key properties of N-(4-fluorophenyl)-2-(propylamino)acetamide?
N-(4-fluorophenyl)-2-(propylamino)acetamide has a molecular weight of 210.25 g/mol, XLogP of 1.76, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-(propylamino)acetamide is sourced from PubChem (CID 28586343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).