N-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide

C11H13FN2O2 — CID 103101753

IUPACN-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide
SMILESCCN(CC(N)=O)C(=O)c1ccc(F)cc1
InChIInChI=1S/C11H13FN2O2/c1-2-14(7-10(13)15)11(16)8-3-5-9(12)6-4-8/h3-6H,2,7H2,1H3,(H2,13,15)
InChIKeyALOUXSOAQUORBE-UHFFFAOYSA-N
MW224.24 g/mol
LogP0.77
Rot. Bonds4

About N-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide

N-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide (PubChem CID 103101753) has the molecular formula C11H13FN2O2 and a molecular weight of 224.24 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide
PubChem CID103101753
Molecular FormulaC11H13FN2O2
Molecular Weight224.24 g/mol
Exact Mass224.10
IUPAC NameN-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide
SMILESCCN(CC(N)=O)C(=O)c1ccc(F)cc1
InChIInChI=1S/C11H13FN2O2/c1-2-14(7-10(13)15)11(16)8-3-5-9(12)6-4-8/h3-6H,2,7H2,1H3,(H2,13,15)
InChIKeyALOUXSOAQUORBE-UHFFFAOYSA-N
XLogP0.77
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.24
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-oxoethyl)-N-ethyl-4-[(Z)-N'-hydroxycarbamimidoyl]benzamide
CID 103103729
N-(2-amino-2-oxoethyl)-N-ethyl-2-fluoropyridine-4-carboxamide
CID 103101741
3-[ethyl-(4-fluorobenzoyl)amino]propanoic acid
CID 61006685
N-ethyl-4-fluoro-N-(thiophen-2-ylmethyl)benzamide
CID 60655445
3-amino-N-(2-amino-2-oxoethyl)-N-ethyl-4-(trifluoromethoxy)benzamide
CID 103100896
N-(2-amino-2-oxoethyl)-N-ethyl-2-oxo-1,3-dihydroindole-6-carboxamide
CID 103103778
N-(2-amino-2-oxoethyl)-N-ethyl-2,3-difluorobenzamide
CID 103101747
4-carbamothioyl-N-ethyl-N-(2,2,2-trifluoroethyl)benzamide
CID 55009098
N,N-bis(2-amino-2-oxoethyl)-3-bromo-4-fluorobenzamide
CID 103707264
4-fluoro-N,N-bis(2-methylpropyl)benzamide
CID 17386163
ethyl 7-[ethyl-(4-fluorobenzoyl)amino]heptanoate
CID 163254624
N-(3-amino-3-sulfanylidenepropyl)-N-[2-(dimethylamino)ethyl]-4-fluorobenzamide
CID 82104174

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide (CID 103101753) is N-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide is CCN(CC(N)=O)C(=O)c1ccc(F)cc1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide?
The InChIKey is ALOUXSOAQUORBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O2/c1-2-14(7-10(13)15)11(16)8-3-5-9(12)6-4-8/h3-6H,2,7H2,1H3,(H2,13,15).
What are the key properties of N-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide?
N-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide has a molecular weight of 224.24 g/mol, XLogP of 0.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-ethyl-4-fluorobenzamide is sourced from PubChem (CID 103101753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).