4-(1-aminopentyl)thiophene-2-sulfonamide

C9H16N2O2S2 — CID 10037665

IUPAC4-(1-aminopentyl)thiophene-2-sulfonamide
SMILESCCCCC(N)c1csc(S(N)(=O)=O)c1
InChIInChI=1S/C9H16N2O2S2/c1-2-3-4-8(10)7-5-9(14-6-7)15(11,12)13/h5-6,8H,2-4,10H2,1H3,(H2,11,12,13)
InChIKeyMBEQHZLHLIYHMF-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.59
Rot. Bonds5

About 4-(1-aminopentyl)thiophene-2-sulfonamide

4-(1-aminopentyl)thiophene-2-sulfonamide (PubChem CID 10037665) has the molecular formula C9H16N2O2S2 and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-(1-aminopentyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-(1-aminopentyl)thiophene-2-sulfonamide
PubChem CID10037665
Molecular FormulaC9H16N2O2S2
Molecular Weight248.37 g/mol
Exact Mass248.07
IUPAC Name4-(1-aminopentyl)thiophene-2-sulfonamide
SMILESCCCCC(N)c1csc(S(N)(=O)=O)c1
InChIInChI=1S/C9H16N2O2S2/c1-2-3-4-8(10)7-5-9(14-6-7)15(11,12)13/h5-6,8H,2-4,10H2,1H3,(H2,11,12,13)
InChIKeyMBEQHZLHLIYHMF-UHFFFAOYSA-N
XLogP1.59
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(1-aminopentyl)thiophene-2-sulfonamide?
The IUPAC name of 4-(1-aminopentyl)thiophene-2-sulfonamide (CID 10037665) is 4-(1-aminopentyl)thiophene-2-sulfonamide.
What is the SMILES notation for 4-(1-aminopentyl)thiophene-2-sulfonamide?
The canonical SMILES for 4-(1-aminopentyl)thiophene-2-sulfonamide is CCCCC(N)c1csc(S(N)(=O)=O)c1.
What is the InChIKey of 4-(1-aminopentyl)thiophene-2-sulfonamide?
The InChIKey is MBEQHZLHLIYHMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2S2/c1-2-3-4-8(10)7-5-9(14-6-7)15(11,12)13/h5-6,8H,2-4,10H2,1H3,(H2,11,12,13).
What are the key properties of 4-(1-aminopentyl)thiophene-2-sulfonamide?
4-(1-aminopentyl)thiophene-2-sulfonamide has a molecular weight of 248.37 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-aminopentyl)thiophene-2-sulfonamide is sourced from PubChem (CID 10037665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).