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

C16H19FN2OS — CID 115286679

IUPAC2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide
SMILESCCN(C(=O)C(N)c1cccs1)C(C)c1ccc(F)cc1
InChIInChI=1S/C16H19FN2OS/c1-3-19(11(2)12-6-8-13(17)9-7-12)16(20)15(18)14-5-4-10-21-14/h4-11,15H,3,18H2,1-2H3
InChIKeyNAZSXKWIHANZNX-UHFFFAOYSA-N
MW306.41 g/mol
LogP3.50
Rot. Bonds5

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

2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide (PubChem CID 115286679) has the molecular formula C16H19FN2OS and a molecular weight of 306.41 g/mol. Its IUPAC name is 2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound Name2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide
PubChem CID115286679
Molecular FormulaC16H19FN2OS
Molecular Weight306.41 g/mol
Exact Mass306.12
IUPAC Name2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide
SMILESCCN(C(=O)C(N)c1cccs1)C(C)c1ccc(F)cc1
InChIInChI=1S/C16H19FN2OS/c1-3-19(11(2)12-6-8-13(17)9-7-12)16(20)15(18)14-5-4-10-21-14/h4-11,15H,3,18H2,1-2H3
InChIKeyNAZSXKWIHANZNX-UHFFFAOYSA-N
XLogP3.50
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-methyl-3-phenylpropanamide;hydrochloride
CID 119737212
2-amino-N-[(4-fluorophenyl)methyl]-N-methyl-2-thiophen-2-ylacetamide
CID 115286090
N-ethyl-N-[1-(4-fluorophenyl)ethyl]acetamide
CID 60794877
5-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-methylpentanamide
CID 104684492
N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpropanamide
CID 86850077
5-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]hexanamide
CID 82852194
2-amino-N-methyl-2-thiophen-2-yl-N-(1-thiophen-2-ylethyl)acetamide
CID 115286728
3-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-3-phenylpropanamide
CID 119950245
2-amino-N-ethyl-2-thiophen-2-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 113279196
N-ethyl-3-(ethylamino)-N-[1-(4-fluorophenyl)ethyl]-2-methylpropanamide
CID 62853654
2-amino-N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-2-thiophen-2-ylacetamide
CID 115286709
2-amino-N-methyl-N-propan-2-yl-2-thiophen-2-ylacetamide
CID 115285914

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide?
The IUPAC name of 2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide (CID 115286679) is 2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for 2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for 2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide is CCN(C(=O)C(N)c1cccs1)C(C)c1ccc(F)cc1.
What is the InChIKey of 2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide?
The InChIKey is NAZSXKWIHANZNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2OS/c1-3-19(11(2)12-6-8-13(17)9-7-12)16(20)15(18)14-5-4-10-21-14/h4-11,15H,3,18H2,1-2H3.
What are the key properties of 2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide?
2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide has a molecular weight of 306.41 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 115286679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).