N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide

C14H19NO3S2 — CID 71979152

IUPACN-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide
SMILESCC(C1CC1)N(C(=O)CS(=O)(=O)c1cccs1)C1CC1
InChIInChI=1S/C14H19NO3S2/c1-10(11-4-5-11)15(12-6-7-12)13(16)9-20(17,18)14-3-2-8-19-14/h2-3,8,10-12H,4-7,9H2,1H3
InChIKeyYLWJDWIUHPOZIN-UHFFFAOYSA-N
MW313.44 g/mol
LogP2.31
Rot. Bonds6

About N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide

N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide (PubChem CID 71979152) has the molecular formula C14H19NO3S2 and a molecular weight of 313.44 g/mol. Its IUPAC name is N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide
PubChem CID71979152
Molecular FormulaC14H19NO3S2
Molecular Weight313.44 g/mol
Exact Mass313.08
IUPAC NameN-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide
SMILESCC(C1CC1)N(C(=O)CS(=O)(=O)c1cccs1)C1CC1
InChIInChI=1S/C14H19NO3S2/c1-10(11-4-5-11)15(12-6-7-12)13(16)9-20(17,18)14-3-2-8-19-14/h2-3,8,10-12H,4-7,9H2,1H3
InChIKeyYLWJDWIUHPOZIN-UHFFFAOYSA-N
XLogP2.31
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.44
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopentyl-2-thiophen-2-ylsulfonylethanone
CID 104756093
N-cyclopropyl-N-[(1R)-1-cyclopropylethyl]-2-[(2R)-3-oxo-2-thiophen-2-ylpiperazin-1-yl]acetamide
CID 95903256
N-cyclopropyl-N-(1-cyclopropylethyl)-2-(3-methylsulfonylphenoxy)acetamide
CID 75461588
N-(dicyclopropylmethyl)thiophene-2-sulfonamide
CID 31846779
3-[acetyl(benzyl)amino]-N-cyclopropyl-N-[(1R)-1-cyclopropylethyl]propanamide
CID 95597220
2-[cyclopropyl(6-thiophen-2-ylhexanoyl)amino]propanoic acid
CID 119203403
5-thiophen-2-ylsulfonylpentan-2-amine
CID 64644611
N-cyclopropyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide
CID 43577528
N-cyclopropyl-N-ethyl-2-[4-(thiophen-2-ylsulfonylamino)piperidin-1-yl]acetamide
CID 55648993
1-(1,3-dihydroisoindol-2-yl)-2-thiophen-2-ylsulfonylethanone
CID 166512178
2-cyclopropyl-2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetic acid
CID 62696486
N-cyclopropyl-N-ethyl-2-[[(1R)-1-thiophen-2-ylethyl]amino]acetamide
CID 81408188

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide?
The IUPAC name of N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide (CID 71979152) is N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide.
What is the SMILES notation for N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide?
The canonical SMILES for N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide is CC(C1CC1)N(C(=O)CS(=O)(=O)c1cccs1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide?
The InChIKey is YLWJDWIUHPOZIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3S2/c1-10(11-4-5-11)15(12-6-7-12)13(16)9-20(17,18)14-3-2-8-19-14/h2-3,8,10-12H,4-7,9H2,1H3.
What are the key properties of N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide?
N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide has a molecular weight of 313.44 g/mol, XLogP of 2.31, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide is sourced from PubChem (CID 71979152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).