N'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine

C12H27N3O2S — CID 43137008

IUPACN'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine
SMILESCCN(CC)S(=O)(=O)N(CCCN)C1CCCC1
InChIInChI=1S/C12H27N3O2S/c1-3-14(4-2)18(16,17)15(11-7-10-13)12-8-5-6-9-12/h12H,3-11,13H2,1-2H3
InChIKeyVIONKSQJHMOVOE-UHFFFAOYSA-N
MW277.43 g/mol
LogP1.17
Rot. Bonds8

About N'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine

N'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine (PubChem CID 43137008) has the molecular formula C12H27N3O2S and a molecular weight of 277.43 g/mol. Its IUPAC name is N'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine
PubChem CID43137008
Molecular FormulaC12H27N3O2S
Molecular Weight277.43 g/mol
Exact Mass277.18
IUPAC NameN'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine
SMILESCCN(CC)S(=O)(=O)N(CCCN)C1CCCC1
InChIInChI=1S/C12H27N3O2S/c1-3-14(4-2)18(16,17)15(11-7-10-13)12-8-5-6-9-12/h12H,3-11,13H2,1-2H3
InChIKeyVIONKSQJHMOVOE-UHFFFAOYSA-N
XLogP1.17
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.43
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 53529219
N-(3-aminobutyl)azepane-1-sulfonamide
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4-Amino-n,n-dimethylpiperidine-1-sulfonamide
CID 28787699
[3-Aminopropyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane
CID 114803455
N-(dimethylsulfamoyl)-N-methylpiperidin-4-amine
CID 20735446
4-(Diethylsulfamoylamino)piperidine
CID 21899491
Dimethyl[(1-methylpiperidin-4-yl)sulfamoyl]amine
CID 23537508
N-propan-2-ylpiperidine-1-sulfonamide
CID 57538873
N-(propan-2-ylsulfamoyl)cyclopentanamine
CID 57538874
N,N-dimethyl-4-(methylamino)piperidine-1-sulfonamide
CID 57581218
1-Butyl-4-(dimethylsulfamoylamino)piperidine
CID 58602933
1-Butyl-4-(dimethylsulfamoylamino)piperidine
CID 58602934

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine?
The IUPAC name of N'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine (CID 43137008) is N'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine?
The canonical SMILES for N'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine is CCN(CC)S(=O)(=O)N(CCCN)C1CCCC1.
What is the InChIKey of N'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine?
The InChIKey is VIONKSQJHMOVOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3O2S/c1-3-14(4-2)18(16,17)15(11-7-10-13)12-8-5-6-9-12/h12H,3-11,13H2,1-2H3.
What are the key properties of N'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine?
N'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine has a molecular weight of 277.43 g/mol, XLogP of 1.17, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-(diethylsulfamoyl)propane-1,3-diamine is sourced from PubChem (CID 43137008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).