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

C14H30ClN3O2S — CID 119976327

IUPACN-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride
SMILESCCCN(C1CCNC1)S(=O)(=O)N(C)C1CCCCC1.Cl
InChIInChI=1S/C14H29N3O2S.ClH/c1-3-11-17(14-9-10-15-12-14)20(18,19)16(2)13-7-5-4-6-8-13;/h13-15H,3-12H2,1-2H3;1H
InChIKeyYSQMPYWVEAHKBO-UHFFFAOYSA-N
MW339.93 g/mol
LogP1.99
Rot. Bonds6

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

N-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride (PubChem CID 119976327) has the molecular formula C14H30ClN3O2S and a molecular weight of 339.93 g/mol. Its IUPAC name is N-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride.

Molecular Properties

Compound NameN-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride
PubChem CID119976327
Molecular FormulaC14H30ClN3O2S
Molecular Weight339.93 g/mol
Exact Mass339.17
IUPAC NameN-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride
SMILESCCCN(C1CCNC1)S(=O)(=O)N(C)C1CCCCC1.Cl
InChIInChI=1S/C14H29N3O2S.ClH/c1-3-11-17(14-9-10-15-12-14)20(18,19)16(2)13-7-5-4-6-8-13;/h13-15H,3-12H2,1-2H3;1H
InChIKeyYSQMPYWVEAHKBO-UHFFFAOYSA-N
XLogP1.99
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.93
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclohexyl(methyl)sulfamoyl]-N-propylazetidin-3-amine
CID 66213871
N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride
CID 119978613
N-propyl-N-pyrrolidin-3-ylethanesulfonamide
CID 60805146
N-propyl-N-pyrrolidin-3-ylpropane-1-sulfonamide;hydrochloride
CID 119976707
N-piperidin-3-yl-N-propylethanesulfonamide
CID 60806396
N-[butyl(methyl)sulfamoyl]-N-methylpiperidin-3-amine
CID 63644066
N-propyl-N-pyrrolidin-3-ylprop-2-ene-1-sulfonamide
CID 79673607
1-(oxan-2-yl)-N-propyl-N-pyrrolidin-3-ylmethanesulfonamide
CID 119976345
N-propyl-N-[(3S)-pyrrolidin-3-yl]thiophene-2-sulfonamide
CID 95395150
1-cyclohexyl-N-methyl-N-pyrrolidin-3-ylmethanesulfonamide;hydrochloride
CID 119978920
1-N,1-N-dimethyl-3-N-propyl-3-N-pyrrolidin-3-ylbenzene-1,3-disulfonamide
CID 119976410
2-fluoro-N-propyl-N-pyrrolidin-3-ylbenzenesulfonamide;hydrochloride
CID 119976534

Frequently Asked Questions

What is the IUPAC name of N-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride?
The IUPAC name of N-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride (CID 119976327) is N-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride.
What is the SMILES notation for N-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride?
The canonical SMILES for N-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride is CCCN(C1CCNC1)S(=O)(=O)N(C)C1CCCCC1.Cl.
What is the InChIKey of N-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride?
The InChIKey is YSQMPYWVEAHKBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2S.ClH/c1-3-11-17(14-9-10-15-12-14)20(18,19)16(2)13-7-5-4-6-8-13;/h13-15H,3-12H2,1-2H3;1H.
What are the key properties of N-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride?
N-[cyclohexyl(methyl)sulfamoyl]-N-propylpyrrolidin-3-amine;hydrochloride has a molecular weight of 339.93 g/mol, XLogP of 1.99, 6 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-propylpyrrolidin-3-amine;hydrochloride is sourced from PubChem (CID 119976327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).