N-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide

C19H17NO4S2 — CID 19210466

IUPACN-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide
SMILESCCOc1ccc(N(C(=O)c2cccs2)S(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C19H17NO4S2/c1-2-24-16-12-10-15(11-13-16)20(19(21)18-9-6-14-25-18)26(22,23)17-7-4-3-5-8-17/h3-14H,2H2,1H3
InChIKeyCVKJEYNKAQSFAP-UHFFFAOYSA-N
MW387.48 g/mol
LogP4.18
Rot. Bonds6

About N-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide

N-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide (PubChem CID 19210466) has the molecular formula C19H17NO4S2 and a molecular weight of 387.48 g/mol. Its IUPAC name is N-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide
PubChem CID19210466
Molecular FormulaC19H17NO4S2
Molecular Weight387.48 g/mol
Exact Mass387.06
IUPAC NameN-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide
SMILESCCOc1ccc(N(C(=O)c2cccs2)S(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C19H17NO4S2/c1-2-24-16-12-10-15(11-13-16)20(19(21)18-9-6-14-25-18)26(22,23)17-7-4-3-5-8-17/h3-14H,2H2,1H3
InChIKeyCVKJEYNKAQSFAP-UHFFFAOYSA-N
XLogP4.18
TPSA63.68 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methylphenyl)-N-(4-methylphenyl)sulfonylthiophene-2-carboxamide
CID 19210463
N-(benzenesulfonyl)-N-(4-ethoxyphenyl)-2-methoxybenzamide
CID 19210850
N-(4-ethoxyphenyl)-N-(4-methylphenyl)sulfonyl-4-phenylbenzamide
CID 19211132
N-(benzenesulfonyl)-N-(4-ethoxyphenyl)-3-nitrobenzamide
CID 19211370
N-(4-ethoxyphenyl)-N-(thiophen-2-ylmethyl)thiophene-2-carboxamide
CID 17013288
N-(4-butylphenyl)-N-(4-methylphenyl)sulfonylthiophene-2-carboxamide
CID 19210471
N-(4-ethoxyphenyl)-2-iodo-N-(4-methylphenyl)sulfonylbenzamide
CID 19219342
N-(benzenesulfonyl)-2-(4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 19212675
N-(benzenesulfonyl)-2-(4-bromo-3-methylphenoxy)-N-(4-ethoxyphenyl)acetamide
CID 19217988
N-(4-ethoxyphenyl)-2-(4-methylphenoxy)-N-(4-methylphenyl)sulfonylacetamide
CID 19212681
(E)-N-(benzenesulfonyl)-3-(3,4-diethoxyphenyl)-N-(4-ethoxyphenyl)prop-2-enamide
CID 19212409
N-(benzenesulfonyl)-N-(4-ethylphenyl)-2-(4-methylphenoxy)acetamide
CID 19212677

Frequently Asked Questions

What is the IUPAC name of N-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide?
The IUPAC name of N-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide (CID 19210466) is N-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide?
The canonical SMILES for N-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide is CCOc1ccc(N(C(=O)c2cccs2)S(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of N-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide?
The InChIKey is CVKJEYNKAQSFAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO4S2/c1-2-24-16-12-10-15(11-13-16)20(19(21)18-9-6-14-25-18)26(22,23)17-7-4-3-5-8-17/h3-14H,2H2,1H3.
What are the key properties of N-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide?
N-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide has a molecular weight of 387.48 g/mol, XLogP of 4.18, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzenesulfonyl)-N-(4-ethoxyphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 19210466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).