N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide

C9H10N2O3S2 — CID 110722045

IUPACN-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide
SMILESO=S(=O)(NCCc1cocn1)c1cccs1
InChIInChI=1S/C9H10N2O3S2/c12-16(13,9-2-1-5-15-9)11-4-3-8-6-14-7-10-8/h1-2,5-7,11H,3-4H2
InChIKeyRRMWNDQIUYKGRX-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.26
Rot. Bonds5

About N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide

N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide (PubChem CID 110722045) has the molecular formula C9H10N2O3S2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide
PubChem CID110722045
Molecular FormulaC9H10N2O3S2
Molecular Weight258.32 g/mol
Exact Mass258.01
IUPAC NameN-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide
SMILESO=S(=O)(NCCc1cocn1)c1cccs1
InChIInChI=1S/C9H10N2O3S2/c12-16(13,9-2-1-5-15-9)11-4-3-8-6-14-7-10-8/h1-2,5-7,11H,3-4H2
InChIKeyRRMWNDQIUYKGRX-UHFFFAOYSA-N
XLogP1.26
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide
CID 110722046
N-[2-(1,3-benzoxazol-5-yl)ethyl]thiophene-2-sulfonamide
CID 110707437
N-[2-(2-methyl-1H-imidazol-5-yl)ethyl]thiophene-2-sulfonamide
CID 110666587
N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide
CID 110605316
N-[2-(3,4-dichlorophenyl)ethyl]thiophene-2-sulfonamide
CID 3810708
N-[2-(methylamino)ethyl]thiophene-2-sulfonamide
CID 62658549
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]thiophene-2-sulfonamide
CID 110646333
N-[2-[4-(azepan-1-yl)phenyl]ethyl]thiophene-2-sulfonamide
CID 16890340
N-[2-(1,3-oxazol-4-yl)ethyl]-2,3-dihydro-1H-indene-5-sulfonamide
CID 110722088
N-(2-aminooxyethyl)thiophene-2-sulfonamide
CID 39245279
N-(3-aminopropyl)thiophene-2-sulfonamide;hydrochloride
CID 119962042
N-pentylthiophene-2-sulfonamide
CID 5150701

Frequently Asked Questions

What is the IUPAC name of N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide?
The IUPAC name of N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide (CID 110722045) is N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide is O=S(=O)(NCCc1cocn1)c1cccs1.
What is the InChIKey of N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide?
The InChIKey is RRMWNDQIUYKGRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O3S2/c12-16(13,9-2-1-5-15-9)11-4-3-8-6-14-7-10-8/h1-2,5-7,11H,3-4H2.
What are the key properties of N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide?
N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide has a molecular weight of 258.32 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,3-oxazol-4-yl)ethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 110722045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).