N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine

C14H29N3O2S — CID 106599557

IUPACN-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine
SMILESCCCN(CCC)S(=O)(=O)N(CC1CCCN1)C1CC1
InChIInChI=1S/C14H29N3O2S/c1-3-10-16(11-4-2)20(18,19)17(14-7-8-14)12-13-6-5-9-15-13/h13-15H,3-12H2,1-2H3
InChIKeyXIYZSJAVCYGCIS-UHFFFAOYSA-N
MW303.47 g/mol
LogP1.57
Rot. Bonds9

About N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine

N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine (PubChem CID 106599557) has the molecular formula C14H29N3O2S and a molecular weight of 303.47 g/mol. Its IUPAC name is N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine.

Molecular Properties

Compound NameN-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine
PubChem CID106599557
Molecular FormulaC14H29N3O2S
Molecular Weight303.47 g/mol
Exact Mass303.20
IUPAC NameN-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine
SMILESCCCN(CCC)S(=O)(=O)N(CC1CCCN1)C1CC1
InChIInChI=1S/C14H29N3O2S/c1-3-10-16(11-4-2)20(18,19)17(14-7-8-14)12-13-6-5-9-15-13/h13-15H,3-12H2,1-2H3
InChIKeyXIYZSJAVCYGCIS-UHFFFAOYSA-N
XLogP1.57
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.47
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(dimethylsulfamoyl)-N-(piperidin-2-ylmethyl)cyclopropanamine
CID 106630069
N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine
CID 79702592
1-methylsulfonyl-N-propyl-N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 106608529
N-cyclopropyl-N-(piperidin-2-ylmethyl)butane-1-sulfonamide
CID 106630038
N-(piperidin-2-ylmethyl)-N-propylcyclohexanesulfonamide
CID 106630664
N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide
CID 106608788
N-cyclopropyl-4-ethyl-N-(pyrrolidin-2-ylmethyl)benzenesulfonamide
CID 106599587
3,5-dimethyl-N-propyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106608418
2-[[cyclopropylsulfamoyl(propyl)amino]methyl]piperidine
CID 106630652
2-[2-(dipropylsulfamoylamino)ethyl]pyrrolidine
CID 114794083
N-cyclopropyl-3,5-dimethyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106599585
2-ethyl-N-propyl-N-(pyrrolidin-2-ylmethyl)-1H-imidazole-5-sulfonamide
CID 106608449

Frequently Asked Questions

What is the IUPAC name of N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine?
The IUPAC name of N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine (CID 106599557) is N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine.
What is the SMILES notation for N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine?
The canonical SMILES for N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine is CCCN(CCC)S(=O)(=O)N(CC1CCCN1)C1CC1.
What is the InChIKey of N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine?
The InChIKey is XIYZSJAVCYGCIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2S/c1-3-10-16(11-4-2)20(18,19)17(14-7-8-14)12-13-6-5-9-15-13/h13-15H,3-12H2,1-2H3.
What are the key properties of N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine?
N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine has a molecular weight of 303.47 g/mol, XLogP of 1.57, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine is sourced from PubChem (CID 106599557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).