N-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide

C17H20N2O3S2 — CID 1305863

IUPACN-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C17H20N2O3S2/c20-17(13-15-5-4-12-23-15)18-14-6-8-16(9-7-14)24(21,22)19-10-2-1-3-11-19/h4-9,12H,1-3,10-11,13H2,(H,18,20)
InChIKeyAPTRCSYUVHJRJR-UHFFFAOYSA-N
MW364.49 g/mol
LogP3.10
Rot. Bonds5

About N-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide

N-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide (PubChem CID 1305863) has the molecular formula C17H20N2O3S2 and a molecular weight of 364.49 g/mol. Its IUPAC name is N-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide
PubChem CID1305863
Molecular FormulaC17H20N2O3S2
Molecular Weight364.49 g/mol
Exact Mass364.09
IUPAC NameN-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C17H20N2O3S2/c20-17(13-15-5-4-12-23-15)18-14-6-8-16(9-7-14)24(21,22)19-10-2-1-3-11-19/h4-9,12H,1-3,10-11,13H2,(H,18,20)
InChIKeyAPTRCSYUVHJRJR-UHFFFAOYSA-N
XLogP3.10
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-piperidin-1-ylsulfonylphenyl)-3-thiophen-2-ylpropanamide
CID 8614889
N-(4-piperidin-1-ylsulfonylphenyl)-2-(thiophen-2-ylmethylamino)acetamide chloride
CID 53347816
N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-thiophen-2-ylacetamide
CID 4303625
N-[2-(4-piperidin-1-ylsulfonylphenyl)ethyl]-2-thiophen-2-ylacetamide
CID 30125667
N-[4-[4-(2-thiophen-2-ylacetyl)piperazin-1-yl]sulfonylphenyl]acetamide
CID 108569277
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
CID 24627396
(2R)-2-[methyl(thiophen-2-ylmethyl)amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide
CID 8516869
2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 31703372
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-methylphenyl)acetamide
CID 1291427
(2S)-2-[ethyl(thiophen-2-ylmethyl)amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide
CID 8718360
(3R)-3-acetamido-N-[4-(azepan-1-ylsulfonyl)phenyl]-3-thiophen-2-ylpropanamide
CID 26062626
N-(4-piperidin-1-ylsulfonylphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 134049827

Frequently Asked Questions

What is the IUPAC name of N-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide (CID 1305863) is N-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1.
What is the InChIKey of N-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide?
The InChIKey is APTRCSYUVHJRJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S2/c20-17(13-15-5-4-12-23-15)18-14-6-8-16(9-7-14)24(21,22)19-10-2-1-3-11-19/h4-9,12H,1-3,10-11,13H2,(H,18,20).
What are the key properties of N-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide?
N-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide has a molecular weight of 364.49 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 1305863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).