N-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide

C12H26N4O2S — CID 174571641

IUPACN-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide
SMILESCCN(N1CCN(C)CC1)S(=O)(=O)N1CCCCC1
InChIInChI=1S/C12H26N4O2S/c1-3-16(14-11-9-13(2)10-12-14)19(17,18)15-7-5-4-6-8-15/h3-12H2,1-2H3
InChIKeyIVLLEGHEAVNZEG-UHFFFAOYSA-N
MW290.43 g/mol
LogP0.20
Rot. Bonds4

About N-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide

N-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide (PubChem CID 174571641) has the molecular formula C12H26N4O2S and a molecular weight of 290.43 g/mol. Its IUPAC name is N-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide
PubChem CID174571641
Molecular FormulaC12H26N4O2S
Molecular Weight290.43 g/mol
Exact Mass290.18
IUPAC NameN-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide
SMILESCCN(N1CCN(C)CC1)S(=O)(=O)N1CCCCC1
InChIInChI=1S/C12H26N4O2S/c1-3-16(14-11-9-13(2)10-12-14)19(17,18)15-7-5-4-6-8-15/h3-12H2,1-2H3
InChIKeyIVLLEGHEAVNZEG-UHFFFAOYSA-N
XLogP0.20
TPSA47.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.43
LogP ≤ 50.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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N-(2-chloroethyl)-N-methylpyrrolidine-1-sulfonamide
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1-methyl-4-(3-piperidin-1-ylpropylsulfonyl)piperazine
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ethane;N-ethyl-N-methylethanamine;1-methylazepane;1-methylpiperidine
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1-(chloromethylsulfonyl)-4-methyl-1,4-diazepane
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1-(2-pyrrolidin-1-ylethylsulfonyl)piperidine
CID 90877511
N-ethyl-N-propan-2-ylpropan-2-amine;1-methylpiperidine
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1-(2-methylsulfonylethylsulfonyl)azepane
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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide?
The IUPAC name of N-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide (CID 174571641) is N-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide.
What is the SMILES notation for N-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide?
The canonical SMILES for N-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide is CCN(N1CCN(C)CC1)S(=O)(=O)N1CCCCC1.
What is the InChIKey of N-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide?
The InChIKey is IVLLEGHEAVNZEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N4O2S/c1-3-16(14-11-9-13(2)10-12-14)19(17,18)15-7-5-4-6-8-15/h3-12H2,1-2H3.
What are the key properties of N-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide?
N-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide has a molecular weight of 290.43 g/mol, XLogP of 0.20, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(4-methylpiperazin-1-yl)piperidine-1-sulfonamide is sourced from PubChem (CID 174571641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).