N-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide

C15H20FNOS — CID 134060793

IUPACN-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide
SMILESCCN(C(=O)CSc1ccccc1F)C1CCCC1
InChIInChI=1S/C15H20FNOS/c1-2-17(12-7-3-4-8-12)15(18)11-19-14-10-6-5-9-13(14)16/h5-6,9-10,12H,2-4,7-8,11H2,1H3
InChIKeyCOAHVMFRTYBSNL-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.71
Rot. Bonds5

About N-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide

N-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide (PubChem CID 134060793) has the molecular formula C15H20FNOS and a molecular weight of 281.40 g/mol. Its IUPAC name is N-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide.

Molecular Properties

Compound NameN-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide
PubChem CID134060793
Molecular FormulaC15H20FNOS
Molecular Weight281.40 g/mol
Exact Mass281.12
IUPAC NameN-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide
SMILESCCN(C(=O)CSc1ccccc1F)C1CCCC1
InChIInChI=1S/C15H20FNOS/c1-2-17(12-7-3-4-8-12)15(18)11-19-14-10-6-5-9-13(14)16/h5-6,9-10,12H,2-4,7-8,11H2,1H3
InChIKeyCOAHVMFRTYBSNL-UHFFFAOYSA-N
XLogP3.71
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-amino-2-methylphenyl)sulfanyl-N-cyclohexyl-N-ethylacetamide
CID 79128184
2-(2-amino-3-methylphenyl)sulfanyl-N-cyclohexyl-N-ethylacetamide
CID 79130628
N,N-diethyl-2-(2-fluorophenyl)sulfanylacetamide
CID 60623990
N-cyclohexyl-N-ethyl-2-(4-hydroxyphenyl)sulfanylacetamide
CID 51891785
1-cycloheptyl-2-(2-fluorophenyl)sulfanylethanone
CID 82931688
N-cyclohexyl-2-(2,6-difluoroanilino)-N-ethylacetamide
CID 78822634
2-(2-chlorophenyl)sulfanyl-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide
CID 78760290
N-cyclohexyl-N-ethyl-2-(1-methyl-5-phenylimidazol-2-yl)sulfanylacetamide
CID 55374229
3-[ethyl-[2-(2-fluorophenyl)sulfanylacetyl]amino]butanoic acid
CID 62822271
3-[ethyl-[2-(2-fluorophenyl)sulfanylacetyl]amino]propanoic acid
CID 61007624
N-ethyl-2-(2-fluorophenyl)sulfanyl-N-(2-hydroxy-2-methylpropyl)acetamide
CID 79381034
2-[(3-chloro-2-pyridinyl)sulfanyl]-N-cyclohexyl-N-ethylacetamide
CID 47143139

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide?
The IUPAC name of N-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide (CID 134060793) is N-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide.
What is the SMILES notation for N-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide?
The canonical SMILES for N-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide is CCN(C(=O)CSc1ccccc1F)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide?
The InChIKey is COAHVMFRTYBSNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNOS/c1-2-17(12-7-3-4-8-12)15(18)11-19-14-10-6-5-9-13(14)16/h5-6,9-10,12H,2-4,7-8,11H2,1H3.
What are the key properties of N-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide?
N-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide has a molecular weight of 281.40 g/mol, XLogP of 3.71, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-ethyl-2-(2-fluorophenyl)sulfanylacetamide is sourced from PubChem (CID 134060793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).