N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine

C15H31N3O2S — CID 79702592

IUPACN-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine
SMILESCCCN(CCC)S(=O)(=O)N(CC1CCNCC1)C1CC1
InChIInChI=1S/C15H31N3O2S/c1-3-11-17(12-4-2)21(19,20)18(15-5-6-15)13-14-7-9-16-10-8-14/h14-16H,3-13H2,1-2H3
InChIKeyWFHNGOHGYPQWNJ-UHFFFAOYSA-N
MW317.50 g/mol
LogP1.82
Rot. Bonds9

About N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine

N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine (PubChem CID 79702592) has the molecular formula C15H31N3O2S and a molecular weight of 317.50 g/mol. Its IUPAC name is N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine.

Molecular Properties

Compound NameN-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine
PubChem CID79702592
Molecular FormulaC15H31N3O2S
Molecular Weight317.50 g/mol
Exact Mass317.21
IUPAC NameN-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine
SMILESCCCN(CCC)S(=O)(=O)N(CC1CCNCC1)C1CC1
InChIInChI=1S/C15H31N3O2S/c1-3-11-17(12-4-2)21(19,20)18(15-5-6-15)13-14-7-9-16-10-8-14/h14-16H,3-13H2,1-2H3
InChIKeyWFHNGOHGYPQWNJ-UHFFFAOYSA-N
XLogP1.82
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.50
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[ethyl(piperidin-4-ylmethyl)sulfamoyl]-N-propylpropan-1-amine
CID 79716430
N-(dipropylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)cyclopropanamine
CID 106599557
N-(piperidin-4-ylmethyl)-N-propylpropane-1-sulfonamide
CID 79716434
4-[[methylsulfamoyl(propyl)amino]methyl]piperidine
CID 114811132
1-methylsulfonyl-N-(piperidin-4-ylmethyl)-N-propylmethanesulfonamide
CID 82842868
N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide
CID 82843062
N-butyl-N-cyclopropyl-1-piperidin-4-ylmethanesulfonamide
CID 54972450
N-cyclopropyl-N-(cyclopropylmethyl)ethanesulfonamide
CID 63103163
2-ethoxy-N-(piperidin-4-ylmethyl)-N-propylethanesulfonamide
CID 79717397
2-[cyclobutyl(dipropylsulfamoyl)amino]ethanol
CID 102675795
methyl 3-[cyclopropyl(piperidin-4-ylmethyl)sulfamoyl]propanoate
CID 79717402
1-cyano-N-cyclopropyl-N-(piperidin-4-ylmethyl)ethanesulfonamide
CID 79717240

Frequently Asked Questions

What is the IUPAC name of N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine?
The IUPAC name of N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine (CID 79702592) is N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine.
What is the SMILES notation for N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine?
The canonical SMILES for N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine is CCCN(CCC)S(=O)(=O)N(CC1CCNCC1)C1CC1.
What is the InChIKey of N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine?
The InChIKey is WFHNGOHGYPQWNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O2S/c1-3-11-17(12-4-2)21(19,20)18(15-5-6-15)13-14-7-9-16-10-8-14/h14-16H,3-13H2,1-2H3.
What are the key properties of N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine?
N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine has a molecular weight of 317.50 g/mol, XLogP of 1.82, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine is sourced from PubChem (CID 79702592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).