4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride

C11H26ClN3O2S — CID 120779800

IUPAC4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride
SMILESCCCN(C)S(=O)(=O)N1CCC(N)C(C)(C)C1.Cl
InChIInChI=1S/C11H25N3O2S.ClH/c1-5-7-13(4)17(15,16)14-8-6-10(12)11(2,3)9-14;/h10H,5-9,12H2,1-4H3;1H
InChIKeyFLWKVLKQTBEDFA-UHFFFAOYSA-N
MW299.87 g/mol
LogP1.05
Rot. Bonds4

About 4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride

4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride (PubChem CID 120779800) has the molecular formula C11H26ClN3O2S and a molecular weight of 299.87 g/mol. Its IUPAC name is 4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound Name4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride
PubChem CID120779800
Molecular FormulaC11H26ClN3O2S
Molecular Weight299.87 g/mol
Exact Mass299.14
IUPAC Name4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride
SMILESCCCN(C)S(=O)(=O)N1CCC(N)C(C)(C)C1.Cl
InChIInChI=1S/C11H25N3O2S.ClH/c1-5-7-13(4)17(15,16)14-8-6-10(12)11(2,3)9-14;/h10H,5-9,12H2,1-4H3;1H
InChIKeyFLWKVLKQTBEDFA-UHFFFAOYSA-N
XLogP1.05
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.87
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 3-[(4-amino-3,3-dimethylpiperidin-1-yl)sulfonyl-methylamino]propanoate
CID 120778948
4-amino-N-methyl-N-propylpiperidine-1-sulfonamide
CID 119958974
3,3-dimethyl-1-propylsulfonylpiperidin-4-amine;hydrochloride
CID 120779816
3-amino-N-methyl-N-propylpyrrolidine-1-sulfonamide;hydrochloride
CID 119971553
3,3-dimethyl-1-methylsulfonylpiperidin-4-amine
CID 115269791
3,3-dimethyl-1-(2-methylpentylsulfonyl)piperidin-4-amine;hydrochloride
CID 120779209
1-cyclobutylsulfonyl-3,3-dimethylpiperidin-4-amine
CID 115276642
3-amino-N,4-dimethyl-N-propylpyrrolidine-1-sulfonamide;hydrochloride
CID 120585460
1-(azepan-1-ylsulfonyl)-3,3-dimethylpiperidin-4-amine
CID 120779565
(3S)-3-amino-N-butyl-N-methylpyrrolidine-1-sulfonamide
CID 115302268
N-methyl-N-propyl-3,9-diazabicyclo[4.2.1]nonane-3-sulfonamide
CID 119989155
3,3-dimethyl-1-(4-propoxyphenyl)sulfonylpiperidin-4-amine
CID 120779463

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride?
The IUPAC name of 4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride (CID 120779800) is 4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride.
What is the SMILES notation for 4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride?
The canonical SMILES for 4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride is CCCN(C)S(=O)(=O)N1CCC(N)C(C)(C)C1.Cl.
What is the InChIKey of 4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride?
The InChIKey is FLWKVLKQTBEDFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O2S.ClH/c1-5-7-13(4)17(15,16)14-8-6-10(12)11(2,3)9-14;/h10H,5-9,12H2,1-4H3;1H.
What are the key properties of 4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride?
4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride has a molecular weight of 299.87 g/mol, XLogP of 1.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,3,3-trimethyl-N-propylpiperidine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 120779800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).