(Z)-N-thiophen-2-ylsulfonylhex-2-enamide

C10H13NO3S2 — CID 97377755

IUPAC(Z)-N-thiophen-2-ylsulfonylhex-2-enamide
SMILESCCC/C=C\C(=O)NS(=O)(=O)c1cccs1
InChIInChI=1S/C10H13NO3S2/c1-2-3-4-6-9(12)11-16(13,14)10-7-5-8-15-10/h4-8H,2-3H2,1H3,(H,11,12)/b6-4-
InChIKeyYSJGXMLKEWYSRO-XQRVVYSFSA-N
MW259.35 g/mol
LogP1.91
Rot. Bonds5

About (Z)-N-thiophen-2-ylsulfonylhex-2-enamide

(Z)-N-thiophen-2-ylsulfonylhex-2-enamide (PubChem CID 97377755) has the molecular formula C10H13NO3S2 and a molecular weight of 259.35 g/mol. Its IUPAC name is (Z)-N-thiophen-2-ylsulfonylhex-2-enamide.

Molecular Properties

Compound Name(Z)-N-thiophen-2-ylsulfonylhex-2-enamide
PubChem CID97377755
Molecular FormulaC10H13NO3S2
Molecular Weight259.35 g/mol
Exact Mass259.03
IUPAC Name(Z)-N-thiophen-2-ylsulfonylhex-2-enamide
SMILESCCC/C=C\C(=O)NS(=O)(=O)c1cccs1
InChIInChI=1S/C10H13NO3S2/c1-2-3-4-6-9(12)11-16(13,14)10-7-5-8-15-10/h4-8H,2-3H2,1H3,(H,11,12)/b6-4-
InChIKeyYSJGXMLKEWYSRO-XQRVVYSFSA-N
XLogP1.91
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N-thiophen-2-ylsulfonylprop-2-enamide
CID 139972027
thiophen-2-ylsulfonylurea;urea
CID 19065180
N'-hydroxythiophene-2-sulfonohydrazide
CID 67151955
3-[2-[(4-methylsulfanylphenyl)methyl]phenyl]-N-thiophen-2-ylsulfonylprop-2-enamide
CID 70231371
N-[2-(thiophen-2-ylsulfonylamino)ethyl]pentanamide
CID 108573837
N-thiophen-2-ylsulfonylcyclopropanecarboxamide
CID 47232134
N-pentylthiophene-2-sulfonamide
CID 5150701
N-propyl-2-(thiophen-2-ylsulfonylamino)propanamide
CID 46820888
N'-thiophen-2-ylsulfonylacetohydrazide
CID 8500698
(E)-3-(2-naphthalen-2-yloxyphenyl)-N-thiophen-2-ylsulfonylprop-2-enamide
CID 10113842
methyl (2R)-2-methyl-2-(thiophen-2-ylsulfonylamino)pentanoate
CID 93045702
N-dodecylthiophene-2-sulfonamide
CID 19681497

Frequently Asked Questions

What is the IUPAC name of (Z)-N-thiophen-2-ylsulfonylhex-2-enamide?
The IUPAC name of (Z)-N-thiophen-2-ylsulfonylhex-2-enamide (CID 97377755) is (Z)-N-thiophen-2-ylsulfonylhex-2-enamide.
What is the SMILES notation for (Z)-N-thiophen-2-ylsulfonylhex-2-enamide?
The canonical SMILES for (Z)-N-thiophen-2-ylsulfonylhex-2-enamide is CCC/C=C\C(=O)NS(=O)(=O)c1cccs1.
What is the InChIKey of (Z)-N-thiophen-2-ylsulfonylhex-2-enamide?
The InChIKey is YSJGXMLKEWYSRO-XQRVVYSFSA-N. The full InChI is InChI=1S/C10H13NO3S2/c1-2-3-4-6-9(12)11-16(13,14)10-7-5-8-15-10/h4-8H,2-3H2,1H3,(H,11,12)/b6-4-.
What are the key properties of (Z)-N-thiophen-2-ylsulfonylhex-2-enamide?
(Z)-N-thiophen-2-ylsulfonylhex-2-enamide has a molecular weight of 259.35 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-thiophen-2-ylsulfonylhex-2-enamide is sourced from PubChem (CID 97377755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).