N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide

C16H21F3N2O3S — CID 3216619

IUPACN-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide
SMILESCOCCN(C(=O)C(F)(F)F)C(C(=O)NC1CCCC1)c1cccs1
InChIInChI=1S/C16H21F3N2O3S/c1-24-9-8-21(15(23)16(17,18)19)13(12-7-4-10-25-12)14(22)20-11-5-2-3-6-11/h4,7,10-11,13H,2-3,5-6,8-9H2,1H3,(H,20,22)
InChIKeySLHQQVDPJBSJLT-UHFFFAOYSA-N
MW378.42 g/mol
LogP2.89
Rot. Bonds7

About N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide

N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide (PubChem CID 3216619) has the molecular formula C16H21F3N2O3S and a molecular weight of 378.42 g/mol. Its IUPAC name is N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound NameN-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide
PubChem CID3216619
Molecular FormulaC16H21F3N2O3S
Molecular Weight378.42 g/mol
Exact Mass378.12
IUPAC NameN-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide
SMILESCOCCN(C(=O)C(F)(F)F)C(C(=O)NC1CCCC1)c1cccs1
InChIInChI=1S/C16H21F3N2O3S/c1-24-9-8-21(15(23)16(17,18)19)13(12-7-4-10-25-12)14(22)20-11-5-2-3-6-11/h4,7,10-11,13H,2-3,5-6,8-9H2,1H3,(H,20,22)
InChIKeySLHQQVDPJBSJLT-UHFFFAOYSA-N
XLogP2.89
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.42
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide with MolForge

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Related Compounds

3-methyl-N-(1-morpholino-1-(thiophen-2-yl)propan-2-yl)butanamide
CID 16194567
(4-Isopropyl-piperazin-1-yl)-{5-[(2-methoxy-ethylamino)-methyl]-thiophen-2-yl}-methanone
CID 11587883
N-cyclopentyl-2-[2-oxolanylmethyl-(1-oxo-2-thiophen-2-ylethyl)amino]-2-thiophen-2-ylacetamide
CID 647779
Thiophene-2-carboxylic acid {[(cyclopentylcarbamoyl-thiophen-2-yl-methyl)-(2-methoxy-ethyl)-carbamoyl]-methyl}-amide
CID 649267
N-cyclopentyl-N~2~-(thiophen-2-ylacetyl)-N~2~-(thiophen-2-ylmethyl)isovalinamide
CID 3242787
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)propanamide;hydrochloride
CID 6603216
N-(1-methyl-2-morpholin-4-yl-2-thien-2-ylethyl)-2-oxo-2-piperidin-1-ylacetamide
CID 20866332
2,2-dimethyl-N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide
CID 16194562
4-(2-Hydroxyethyl)-3-(thiophen-2-yl)-3,4,5,6-tetrahydropyrazin-2-ol
CID 3070021
N-[1-(Morpholin-4-YL)-1-(thiophen-2-YL)propan-2-YL]-2-(thiophen-2-YL)acetamide
CID 3237199
N~2~-acetyl-N-cyclopentyl-N~2~-(thiophen-2-ylmethyl)isovalinamide
CID 3240904
N-[2-(4-morpholinyl)-2-(2-thienyl)ethyl]propanamide
CID 2998106

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide?
The IUPAC name of N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide (CID 3216619) is N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide?
The canonical SMILES for N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide is COCCN(C(=O)C(F)(F)F)C(C(=O)NC1CCCC1)c1cccs1.
What is the InChIKey of N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide?
The InChIKey is SLHQQVDPJBSJLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21F3N2O3S/c1-24-9-8-21(15(23)16(17,18)19)13(12-7-4-10-25-12)14(22)20-11-5-2-3-6-11/h4,7,10-11,13H,2-3,5-6,8-9H2,1H3,(H,20,22).
What are the key properties of N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide?
N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide has a molecular weight of 378.42 g/mol, XLogP of 2.89, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 3216619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).