4-amino-N-propan-2-ylpiperidine-1-sulfonamide

C8H19N3O2S — CID 67404925

IUPAC4-amino-N-propan-2-ylpiperidine-1-sulfonamide
SMILESCC(C)NS(=O)(=O)N1CCC(N)CC1
InChIInChI=1S/C8H19N3O2S/c1-7(2)10-14(12,13)11-5-3-8(9)4-6-11/h7-8,10H,3-6,9H2,1-2H3
InChIKeyFYFLGURLXVGDSS-UHFFFAOYSA-N
MW221.33 g/mol
LogP-0.35
Rot. Bonds3

About 4-amino-N-propan-2-ylpiperidine-1-sulfonamide

4-amino-N-propan-2-ylpiperidine-1-sulfonamide (PubChem CID 67404925) has the molecular formula C8H19N3O2S and a molecular weight of 221.33 g/mol. Its IUPAC name is 4-amino-N-propan-2-ylpiperidine-1-sulfonamide.

Molecular Properties

Compound Name4-amino-N-propan-2-ylpiperidine-1-sulfonamide
PubChem CID67404925
Molecular FormulaC8H19N3O2S
Molecular Weight221.33 g/mol
Exact Mass221.12
IUPAC Name4-amino-N-propan-2-ylpiperidine-1-sulfonamide
SMILESCC(C)NS(=O)(=O)N1CCC(N)CC1
InChIInChI=1S/C8H19N3O2S/c1-7(2)10-14(12,13)11-5-3-8(9)4-6-11/h7-8,10H,3-6,9H2,1-2H3
InChIKeyFYFLGURLXVGDSS-UHFFFAOYSA-N
XLogP-0.35
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-propan-2-ylpiperidine-1-sulfonamide?
The IUPAC name of 4-amino-N-propan-2-ylpiperidine-1-sulfonamide (CID 67404925) is 4-amino-N-propan-2-ylpiperidine-1-sulfonamide.
What is the SMILES notation for 4-amino-N-propan-2-ylpiperidine-1-sulfonamide?
The canonical SMILES for 4-amino-N-propan-2-ylpiperidine-1-sulfonamide is CC(C)NS(=O)(=O)N1CCC(N)CC1.
What is the InChIKey of 4-amino-N-propan-2-ylpiperidine-1-sulfonamide?
The InChIKey is FYFLGURLXVGDSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O2S/c1-7(2)10-14(12,13)11-5-3-8(9)4-6-11/h7-8,10H,3-6,9H2,1-2H3.
What are the key properties of 4-amino-N-propan-2-ylpiperidine-1-sulfonamide?
4-amino-N-propan-2-ylpiperidine-1-sulfonamide has a molecular weight of 221.33 g/mol, XLogP of -0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-propan-2-ylpiperidine-1-sulfonamide is sourced from PubChem (CID 67404925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).