N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride

C12H26ClN3O2S — CID 119978613

IUPACN-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride
SMILESCN(C1CCCCC1)S(=O)(=O)N(C)C1CCNC1.Cl
InChIInChI=1S/C12H25N3O2S.ClH/c1-14(11-6-4-3-5-7-11)18(16,17)15(2)12-8-9-13-10-12;/h11-13H,3-10H2,1-2H3;1H
InChIKeyXDPWIVAEKDEYLM-UHFFFAOYSA-N
MW311.88 g/mol
LogP1.21
Rot. Bonds4

About N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride

N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride (PubChem CID 119978613) has the molecular formula C12H26ClN3O2S and a molecular weight of 311.88 g/mol. Its IUPAC name is N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride.

Molecular Properties

Compound NameN-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride
PubChem CID119978613
Molecular FormulaC12H26ClN3O2S
Molecular Weight311.88 g/mol
Exact Mass311.14
IUPAC NameN-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride
SMILESCN(C1CCCCC1)S(=O)(=O)N(C)C1CCNC1.Cl
InChIInChI=1S/C12H25N3O2S.ClH/c1-14(11-6-4-3-5-7-11)18(16,17)15(2)12-8-9-13-10-12;/h11-13H,3-10H2,1-2H3;1H
InChIKeyXDPWIVAEKDEYLM-UHFFFAOYSA-N
XLogP1.21
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.88
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride
CID 119976327
1-cyclohexyl-N-methyl-N-pyrrolidin-3-ylmethanesulfonamide;hydrochloride
CID 119978920
N-methyl-N-[(3R)-piperidin-3-yl]methanesulfonamide;hydrochloride
CID 127263584
3-[[cyclohexyl(methyl)sulfamoyl]amino]pyrrolidine;hydrochloride
CID 119966758
N-methyl-N-piperidin-3-ylmethanesulfonamide
CID 54595457
N-methyl-N-[methyl(piperidin-4-ylmethyl)sulfamoyl]cyclohexanamine
CID 79716658
N,2-dimethyl-N-pyrrolidin-3-ylpropane-2-sulfonamide
CID 63689710
1-cyclopropyl-N-methyl-N-pyrrolidin-3-ylmethanesulfonamide;hydrochloride
CID 119998770
N-[cyclohexyl(methyl)sulfamoyl]-N-propylazetidin-3-amine
CID 66213871
4-N-[cyclohexyl(methyl)sulfamoyl]-4-N-methylcyclohexane-1,4-diamine
CID 79121228
N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine
CID 63644066
N,N-dicyclohexylpyrrolidin-3-amine
CID 78989096

Frequently Asked Questions

What is the IUPAC name of N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride?
The IUPAC name of N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride (CID 119978613) is N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride.
What is the SMILES notation for N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride?
The canonical SMILES for N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride is CN(C1CCCCC1)S(=O)(=O)N(C)C1CCNC1.Cl.
What is the InChIKey of N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride?
The InChIKey is XDPWIVAEKDEYLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2S.ClH/c1-14(11-6-4-3-5-7-11)18(16,17)15(2)12-8-9-13-10-12;/h11-13H,3-10H2,1-2H3;1H.
What are the key properties of N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride?
N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride has a molecular weight of 311.88 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride is sourced from PubChem (CID 119978613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).