4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine

C9H22N4O2S — CID 28940544

IUPAC4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine
SMILESCN1CCC(CN)(NS(=O)(=O)N(C)C)CC1
InChIInChI=1S/C9H22N4O2S/c1-12(2)16(14,15)11-9(8-10)4-6-13(3)7-5-9/h11H,4-8,10H2,1-3H3
InChIKeyNKALGIJYNAKYKR-UHFFFAOYSA-N
MW250.37 g/mol
LogP-1.19
Rot. Bonds4

About 4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine

4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine (PubChem CID 28940544) has the molecular formula C9H22N4O2S and a molecular weight of 250.37 g/mol. Its IUPAC name is 4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine.

Molecular Properties

Compound Name4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine
PubChem CID28940544
Molecular FormulaC9H22N4O2S
Molecular Weight250.37 g/mol
Exact Mass250.15
IUPAC Name4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine
SMILESCN1CCC(CN)(NS(=O)(=O)N(C)C)CC1
InChIInChI=1S/C9H22N4O2S/c1-12(2)16(14,15)11-9(8-10)4-6-13(3)7-5-9/h11H,4-8,10H2,1-3H3
InChIKeyNKALGIJYNAKYKR-UHFFFAOYSA-N
XLogP-1.19
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.37
LogP ≤ 5-1.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-(3-methylbutan-2-yl)piperidine-1-sulfonamide
CID 43053258
4-(Diethylsulfamoylamino)-1-propylpiperidine
CID 53529219
N-(2-amino-2-ethylbutyl)piperidine-1-sulfonamide
CID 91645913
N-(4-methyl-4-piperidinyl)-1-pyrrolidinesulfonamide hydrochloride
CID 114696701
(S)-5-ethyl-2,5-dimethyl-1,2,6-thiadiazinane 1,1-dioxide
CID 138857821
4-(aminomethyl)-1-methyl-N-(2,2,2-trifluoroethylsulfamoyl)piperidin-4-amine
CID 114803347
Dimethyl[(1-methylpiperidin-4-yl)sulfamoyl]amine
CID 23537508
N-ethyl-4-methylpiperidine-1-sulfonamide
CID 43243291
1-Butyl-4-(dimethylsulfamoylamino)piperidine
CID 58602933
1-Butyl-4-(dimethylsulfamoylamino)piperidine
CID 58602934
4-methyl-N-propan-2-ylpiperidine-1-sulfonamide
CID 60728161
5-Ethyl-2,5-dimethyl-1,2,6-thiadiazinane 1,1-dioxide
CID 68643208

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine?
The IUPAC name of 4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine (CID 28940544) is 4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine.
What is the SMILES notation for 4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine?
The canonical SMILES for 4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine is CN1CCC(CN)(NS(=O)(=O)N(C)C)CC1.
What is the InChIKey of 4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine?
The InChIKey is NKALGIJYNAKYKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22N4O2S/c1-12(2)16(14,15)11-9(8-10)4-6-13(3)7-5-9/h11H,4-8,10H2,1-3H3.
What are the key properties of 4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine?
4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine has a molecular weight of 250.37 g/mol, XLogP of -1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-4-(dimethylsulfamoylamino)-1-methylpiperidine is sourced from PubChem (CID 28940544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).