N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide

C11H26N4O2S — CID 114545497

IUPACN-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide
SMILESCC1CN(S(=O)(=O)N(C)CCCN)CC(C)N1C
InChIInChI=1S/C11H26N4O2S/c1-10-8-15(9-11(2)14(10)4)18(16,17)13(3)7-5-6-12/h10-11H,5-9,12H2,1-4H3
InChIKeyOGDCEWYWRAMVJJ-UHFFFAOYSA-N
MW278.42 g/mol
LogP-0.46
Rot. Bonds5

About N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide

N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide (PubChem CID 114545497) has the molecular formula C11H26N4O2S and a molecular weight of 278.42 g/mol. Its IUPAC name is N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide
PubChem CID114545497
Molecular FormulaC11H26N4O2S
Molecular Weight278.42 g/mol
Exact Mass278.18
IUPAC NameN-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide
SMILESCC1CN(S(=O)(=O)N(C)CCCN)CC(C)N1C
InChIInChI=1S/C11H26N4O2S/c1-10-8-15(9-11(2)14(10)4)18(16,17)13(3)7-5-6-12/h10-11H,5-9,12H2,1-4H3
InChIKeyOGDCEWYWRAMVJJ-UHFFFAOYSA-N
XLogP-0.46
TPSA69.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 5-0.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-aminopropyl)-N-methyl-4-propan-2-ylpiperidine-1-sulfonamide
CID 103495211
N-(3-aminopropyl)-N-methylpiperidine-1-sulfonamide
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N-(3-aminopropyl)-N,2-dimethyl-1,4-oxazepane-4-sulfonamide
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N-(3-aminopropyl)-3-(1-hydroxyethyl)-N-methylpyrrolidine-1-sulfonamide
CID 112624880
N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide
CID 62688438
N-(3-aminopropyl)-N-methyl-3,6-dihydro-2H-pyridine-1-sulfonamide
CID 114414187
N-(3-aminopropyl)-3-(hydroxymethyl)-N-methylpiperidine-1-sulfonamide
CID 54951889
N-(3-aminopropyl)-4-(cyclopropylmethyl)-N-methylpiperazine-1-sulfonamide
CID 61456581
N-(3-aminopropyl)-N-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-sulfonamide
CID 79932436
N-(3-aminopropyl)-N-methyl-8-azaspiro[4.5]decane-8-sulfonamide
CID 63159100
N-(3-aminopropyl)-N-methyl-4-methylsulfanylazepane-1-sulfonamide
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N-butyl-N,3,5-trimethylpiperazine-1-sulfonamide
CID 63873091

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide?
The IUPAC name of N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide (CID 114545497) is N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide.
What is the SMILES notation for N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide?
The canonical SMILES for N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide is CC1CN(S(=O)(=O)N(C)CCCN)CC(C)N1C.
What is the InChIKey of N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide?
The InChIKey is OGDCEWYWRAMVJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N4O2S/c1-10-8-15(9-11(2)14(10)4)18(16,17)13(3)7-5-6-12/h10-11H,5-9,12H2,1-4H3.
What are the key properties of N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide?
N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide has a molecular weight of 278.42 g/mol, XLogP of -0.46, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide is sourced from PubChem (CID 114545497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).