4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide

C7H10F2N2O3S2 — CID 106165593

IUPAC4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide
SMILESNc1csc(S(=O)(=O)NCC(F)(F)CO)c1
InChIInChI=1S/C7H10F2N2O3S2/c8-7(9,4-12)3-11-16(13,14)6-1-5(10)2-15-6/h1-2,11-12H,3-4,10H2
InChIKeyDDRGOODWQYQESJ-UHFFFAOYSA-N
MW272.30 g/mol
LogP0.24
Rot. Bonds5

About 4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide

4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide (PubChem CID 106165593) has the molecular formula C7H10F2N2O3S2 and a molecular weight of 272.30 g/mol. Its IUPAC name is 4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide
PubChem CID106165593
Molecular FormulaC7H10F2N2O3S2
Molecular Weight272.30 g/mol
Exact Mass272.01
IUPAC Name4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide
SMILESNc1csc(S(=O)(=O)NCC(F)(F)CO)c1
InChIInChI=1S/C7H10F2N2O3S2/c8-7(9,4-12)3-11-16(13,14)6-1-5(10)2-15-6/h1-2,11-12H,3-4,10H2
InChIKeyDDRGOODWQYQESJ-UHFFFAOYSA-N
XLogP0.24
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 50.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide
CID 63226058
4-amino-N-[2-(trifluoromethylsulfanyl)ethyl]thiophene-2-sulfonamide
CID 106425735
4-amino-N-[2-(methanesulfonamido)ethyl]thiophene-2-sulfonamide
CID 61299780
5-chloro-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide
CID 104858721
4-amino-N-[[3-(hydroxymethyl)phenyl]methyl]thiophene-2-sulfonamide
CID 107212436
4-amino-N-(2-methoxyethyl)thiophene-2-sulfonamide
CID 61301299
5-cyano-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide
CID 114166516
4-amino-N-(2,2-difluoro-3-hydroxypropyl)-3-methylbenzenesulfonamide
CID 106165658
5-amino-N-(2,2-difluoro-3-hydroxypropyl)-4-fluoro-2-methylbenzenesulfonamide
CID 106165792
3-amino-N-(2,2-difluoro-3-hydroxypropyl)-2,6-dimethylbenzenesulfonamide
CID 106165818
5-amino-2-bromo-N-(2,2-difluoro-3-hydroxypropyl)-4-fluorobenzenesulfonamide
CID 106165837
N-(1-adamantylmethyl)-4-aminothiophene-2-sulfonamide
CID 61300366

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide (CID 106165593) is 4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide is Nc1csc(S(=O)(=O)NCC(F)(F)CO)c1.
What is the InChIKey of 4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide?
The InChIKey is DDRGOODWQYQESJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F2N2O3S2/c8-7(9,4-12)3-11-16(13,14)6-1-5(10)2-15-6/h1-2,11-12H,3-4,10H2.
What are the key properties of 4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide?
4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide has a molecular weight of 272.30 g/mol, XLogP of 0.24, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide is sourced from PubChem (CID 106165593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).