1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine

C7H17N3OS — CID 142055427

IUPAC1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine
SMILES[H]N=S(C)(=O)NC1CCN(C)CC1
InChIInChI=1S/C7H17N3OS/c1-10-5-3-7(4-6-10)9-12(2,8)11/h7H,3-6H2,1-2H3,(H2,8,9,11)
InChIKeyXTJCGLFYPPJAND-UHFFFAOYSA-N
MW191.30 g/mol
LogP0.26
Rot. Bonds2

About 1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine

1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine (PubChem CID 142055427) has the molecular formula C7H17N3OS and a molecular weight of 191.30 g/mol. Its IUPAC name is 1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine.

Molecular Properties

Compound Name1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine
PubChem CID142055427
Molecular FormulaC7H17N3OS
Molecular Weight191.30 g/mol
Exact Mass191.11
IUPAC Name1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine
SMILES[H]N=S(C)(=O)NC1CCN(C)CC1
InChIInChI=1S/C7H17N3OS/c1-10-5-3-7(4-6-10)9-12(2,8)11/h7H,3-6H2,1-2H3,(H2,8,9,11)
InChIKeyXTJCGLFYPPJAND-UHFFFAOYSA-N
XLogP0.26
TPSA56.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.30
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-bromo-N-(1-methylpiperidin-4-yl)methanesulfonamide
CID 83084018
1-methyl-N-(1-methylsulfonylpropan-2-yl)piperidin-4-amine
CID 64630112
N-(1-methylpiperidin-4-yl)-1-pyrrolidin-2-ylmethanesulfonamide
CID 54972072
N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide
CID 63859486
N-(1-methylpiperidin-4-yl)-1-piperidin-2-ylmethanesulfonamide
CID 54973820
N-(1-methylpiperidin-4-yl)-4-nitrobenzenesulfonamide
CID 22772515
4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide
CID 61300929
4-hydrazinyl-2,6-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide
CID 107327849
4-chloro-2,5-dimethyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide
CID 22772557
2-cyano-N-(1-methylpiperidin-4-yl)benzenesulfonamide
CID 43215397
4-amino-2-chloro-N-(1-methylpiperidin-4-yl)benzenesulfonamide
CID 43373446
5-bromo-4-methyl-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide
CID 79932001

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine?
The IUPAC name of 1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine (CID 142055427) is 1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine.
What is the SMILES notation for 1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine?
The canonical SMILES for 1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine is [H]N=S(C)(=O)NC1CCN(C)CC1.
What is the InChIKey of 1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine?
The InChIKey is XTJCGLFYPPJAND-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3OS/c1-10-5-3-7(4-6-10)9-12(2,8)11/h7H,3-6H2,1-2H3,(H2,8,9,11).
What are the key properties of 1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine?
1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine has a molecular weight of 191.30 g/mol, XLogP of 0.26, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(methylsulfonimidoyl)piperidin-4-amine is sourced from PubChem (CID 142055427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).