4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide

C10H23N3O2S — CID 114813739

IUPAC4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
SMILESCC(C)CNS(=O)(=O)N1CCC(N)C(C)C1
InChIInChI=1S/C10H23N3O2S/c1-8(2)6-12-16(14,15)13-5-4-10(11)9(3)7-13/h8-10,12H,4-7,11H2,1-3H3
InChIKeyFQYAURHECYPWNE-UHFFFAOYSA-N
MW249.38 g/mol
LogP0.15
Rot. Bonds4

About 4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide

4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide (PubChem CID 114813739) has the molecular formula C10H23N3O2S and a molecular weight of 249.38 g/mol. Its IUPAC name is 4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide.

Molecular Properties

Compound Name4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
PubChem CID114813739
Molecular FormulaC10H23N3O2S
Molecular Weight249.38 g/mol
Exact Mass249.15
IUPAC Name4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
SMILESCC(C)CNS(=O)(=O)N1CCC(N)C(C)C1
InChIInChI=1S/C10H23N3O2S/c1-8(2)6-12-16(14,15)13-5-4-10(11)9(3)7-13/h8-10,12H,4-7,11H2,1-3H3
InChIKeyFQYAURHECYPWNE-UHFFFAOYSA-N
XLogP0.15
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
CID 95141775
3-methyl-1-methylsulfonylpiperidin-4-amine
CID 67385582
3-amino-5-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
CID 114816194
2-(1-aminoethyl)-N-(2-methylpropyl)morpholine-4-sulfonamide
CID 114816233
1-(3,5-dimethylpiperidin-1-yl)sulfonyl-3-methylpiperidin-4-amine;hydrochloride
CID 119984041
N-(2-amino-4-methylpentyl)-3-methylpiperidine-1-sulfonamide
CID 43606393
4-(3-amino-2-methylpropyl)-N-(2-methylpropyl)piperazine-1-sulfonamide
CID 114813812
4-(2-methylpropylsulfamoyl)morpholine-2-carboxylic acid
CID 114814511
1-(2,4-dimethylphenyl)sulfonyl-3-methylpiperidin-4-amine
CID 79867451
4-(4-hydroxyphenyl)-N-(2-methylpropyl)piperidine-1-sulfonamide
CID 114815531
2-methyl-3-[(3-methylpiperidin-1-yl)sulfonylamino]propanethioamide
CID 62665582
1-(2,4-dibromophenyl)sulfonyl-3-methylpiperidin-4-amine
CID 79868686

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide?
The IUPAC name of 4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide (CID 114813739) is 4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide.
What is the SMILES notation for 4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide?
The canonical SMILES for 4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide is CC(C)CNS(=O)(=O)N1CCC(N)C(C)C1.
What is the InChIKey of 4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide?
The InChIKey is FQYAURHECYPWNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O2S/c1-8(2)6-12-16(14,15)13-5-4-10(11)9(3)7-13/h8-10,12H,4-7,11H2,1-3H3.
What are the key properties of 4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide?
4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide has a molecular weight of 249.38 g/mol, XLogP of 0.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide is sourced from PubChem (CID 114813739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).