N-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide

C12H24N4O3S — CID 42955035

IUPACN-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide
SMILESCC(C(=O)NC1CC1)N1CCN(S(=O)(=O)N(C)C)CC1
InChIInChI=1S/C12H24N4O3S/c1-10(12(17)13-11-4-5-11)15-6-8-16(9-7-15)20(18,19)14(2)3/h10-11H,4-9H2,1-3H3,(H,13,17)
InChIKeySUFJJCBNMXNXIL-UHFFFAOYSA-N
MW304.42 g/mol
LogP-0.92
Rot. Bonds5

About N-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide

N-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide (PubChem CID 42955035) has the molecular formula C12H24N4O3S and a molecular weight of 304.42 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide
PubChem CID42955035
Molecular FormulaC12H24N4O3S
Molecular Weight304.42 g/mol
Exact Mass304.16
IUPAC NameN-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide
SMILESCC(C(=O)NC1CC1)N1CCN(S(=O)(=O)N(C)C)CC1
InChIInChI=1S/C12H24N4O3S/c1-10(12(17)13-11-4-5-11)15-6-8-16(9-7-15)20(18,19)14(2)3/h10-11H,4-9H2,1-3H3,(H,13,17)
InChIKeySUFJJCBNMXNXIL-UHFFFAOYSA-N
XLogP-0.92
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 5-0.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide?
The IUPAC name of N-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide (CID 42955035) is N-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide?
The canonical SMILES for N-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide is CC(C(=O)NC1CC1)N1CCN(S(=O)(=O)N(C)C)CC1.
What is the InChIKey of N-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide?
The InChIKey is SUFJJCBNMXNXIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O3S/c1-10(12(17)13-11-4-5-11)15-6-8-16(9-7-15)20(18,19)14(2)3/h10-11H,4-9H2,1-3H3,(H,13,17).
What are the key properties of N-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide?
N-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide has a molecular weight of 304.42 g/mol, XLogP of -0.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]propanamide is sourced from PubChem (CID 42955035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).