N-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide

C17H26N2O4S — CID 45373156

IUPACN-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide
SMILESCCOc1ccc(S(=O)(=O)N(CC)CC(=O)NC2CCCC2)cc1
InChIInChI=1S/C17H26N2O4S/c1-3-19(13-17(20)18-14-7-5-6-8-14)24(21,22)16-11-9-15(10-12-16)23-4-2/h9-12,14H,3-8,13H2,1-2H3,(H,18,20)
InChIKeyVVLZVFVZHDPFTJ-UHFFFAOYSA-N
MW354.47 g/mol
LogP2.15
Rot. Bonds8

About N-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide

N-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide (PubChem CID 45373156) has the molecular formula C17H26N2O4S and a molecular weight of 354.47 g/mol. Its IUPAC name is N-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide
PubChem CID45373156
Molecular FormulaC17H26N2O4S
Molecular Weight354.47 g/mol
Exact Mass354.16
IUPAC NameN-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide
SMILESCCOc1ccc(S(=O)(=O)N(CC)CC(=O)NC2CCCC2)cc1
InChIInChI=1S/C17H26N2O4S/c1-3-19(13-17(20)18-14-7-5-6-8-14)24(21,22)16-11-9-15(10-12-16)23-4-2/h9-12,14H,3-8,13H2,1-2H3,(H,18,20)
InChIKeyVVLZVFVZHDPFTJ-UHFFFAOYSA-N
XLogP2.15
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.47
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[benzenesulfonyl(ethyl)amino]-N-cyclooctylacetamide
CID 45372670
2-[benzenesulfonyl(ethyl)amino]-N-cyclopropylacetamide
CID 2985758
N-cyclopentyl-2-[ethyl-(4-methoxy-3-methylphenyl)sulfonylamino]acetamide
CID 92645415
2-[N-(benzenesulfonyl)-4-ethoxyanilino]-N-cyclohexylacetamide
CID 1141877
2-[(3-chloro-4-methoxyphenyl)sulfonyl-ethylamino]-N-cyclohexylacetamide
CID 92645599
N-(4-acetamidophenyl)-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide
CID 7937656
2-[(4-ethoxyphenyl)sulfonyl-ethylamino]-N-(2-methoxyethyl)acetamide
CID 19798440
2-[(4-ethoxyphenyl)sulfonyl-ethylamino]-N-(4-ethylphenyl)acetamide
CID 45373180
N-cyclopentyl-2-(N-(3,4-dimethoxyphenyl)sulfonyl-4-ethoxyanilino)acetamide
CID 2927933
N-cyclohexyl-2-[(4-methylphenyl)methyl-(4-methylphenyl)sulfonylamino]acetamide
CID 126009784
2-[(4-ethoxyphenyl)sulfonyl-ethylamino]-N-(4-propan-2-ylphenyl)acetamide
CID 45373181
2-[(4-ethoxyphenyl)sulfonyl-ethylamino]-N-(pyridin-4-ylmethyl)acetamide
CID 6493165

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide?
The IUPAC name of N-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide (CID 45373156) is N-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide?
The canonical SMILES for N-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide is CCOc1ccc(S(=O)(=O)N(CC)CC(=O)NC2CCCC2)cc1.
What is the InChIKey of N-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide?
The InChIKey is VVLZVFVZHDPFTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O4S/c1-3-19(13-17(20)18-14-7-5-6-8-14)24(21,22)16-11-9-15(10-12-16)23-4-2/h9-12,14H,3-8,13H2,1-2H3,(H,18,20).
What are the key properties of N-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide?
N-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide has a molecular weight of 354.47 g/mol, XLogP of 2.15, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetamide is sourced from PubChem (CID 45373156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).