4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide

C14H17FN2O2S2 — CID 61301534

IUPAC4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide
SMILESCCN(C(C)c1ccc(F)cc1)S(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C14H17FN2O2S2/c1-3-17(10(2)11-4-6-12(15)7-5-11)21(18,19)14-8-13(16)9-20-14/h4-10H,3,16H2,1-2H3
InChIKeyJYISGTBANSPWAK-UHFFFAOYSA-N
MW328.43 g/mol
LogP3.24
Rot. Bonds5

About 4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide

4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide (PubChem CID 61301534) has the molecular formula C14H17FN2O2S2 and a molecular weight of 328.43 g/mol. Its IUPAC name is 4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide
PubChem CID61301534
Molecular FormulaC14H17FN2O2S2
Molecular Weight328.43 g/mol
Exact Mass328.07
IUPAC Name4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide
SMILESCCN(C(C)c1ccc(F)cc1)S(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C14H17FN2O2S2/c1-3-17(10(2)11-4-6-12(15)7-5-11)21(18,19)14-8-13(16)9-20-14/h4-10H,3,16H2,1-2H3
InChIKeyJYISGTBANSPWAK-UHFFFAOYSA-N
XLogP3.24
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.43
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-ethyl-N-propan-2-ylthiophene-2-sulfonamide
CID 61299968
4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide
CID 103187456
N-ethyl-N-[1-(4-fluorophenyl)ethyl]ethanesulfonamide
CID 61357200
4-amino-N-benzyl-N-propan-2-ylthiophene-2-sulfonamide
CID 61300920
4-amino-N-methyl-N-(2-methylbutyl)thiophene-2-sulfonamide
CID 61300540
N-ethyl-N-[(1S)-1-(4-fluorophenyl)ethyl]triazolo[1,5-a]pyridine-5-sulfonamide
CID 176509363
4-amino-N,N-dibutylthiophene-2-sulfonamide
CID 61301508
N-ethyl-4-fluoro-N-propan-2-ylbenzenesulfonamide
CID 43453699
4-amino-N-[(4-ethylphenyl)methyl]-N-methylthiophene-2-sulfonamide
CID 61299784
4-amino-N-(cyclopropylmethyl)-N-ethylthiophene-2-sulfonamide
CID 63955111
N-ethyl-5-isocyano-N-[(1R)-2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]thiophene-3-sulfonamide
CID 177099805
N,1-diethyl-N-[(1S)-1-(4-fluorophenyl)ethyl]pyrazolo[5,4-b]pyridine-3-sulfonamide
CID 176509397

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide (CID 61301534) is 4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide is CCN(C(C)c1ccc(F)cc1)S(=O)(=O)c1cc(N)cs1.
What is the InChIKey of 4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide?
The InChIKey is JYISGTBANSPWAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O2S2/c1-3-17(10(2)11-4-6-12(15)7-5-11)21(18,19)14-8-13(16)9-20-14/h4-10H,3,16H2,1-2H3.
What are the key properties of 4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide?
4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide has a molecular weight of 328.43 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 61301534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).