N-(3-hydroxycyclohexyl)piperazine-1-sulfonamide

C10H21N3O3S — CID 61252359

IUPACN-(3-hydroxycyclohexyl)piperazine-1-sulfonamide
SMILESO=S(=O)(NC1CCCC(O)C1)N1CCNCC1
InChIInChI=1S/C10H21N3O3S/c14-10-3-1-2-9(8-10)12-17(15,16)13-6-4-11-5-7-13/h9-12,14H,1-8H2
InChIKeyUNCQTVKEPWDOPH-UHFFFAOYSA-N
MW263.36 g/mol
LogP-0.97
Rot. Bonds3

About N-(3-hydroxycyclohexyl)piperazine-1-sulfonamide

N-(3-hydroxycyclohexyl)piperazine-1-sulfonamide (PubChem CID 61252359) has the molecular formula C10H21N3O3S and a molecular weight of 263.36 g/mol. Its IUPAC name is N-(3-hydroxycyclohexyl)piperazine-1-sulfonamide.

Molecular Properties

Compound NameN-(3-hydroxycyclohexyl)piperazine-1-sulfonamide
PubChem CID61252359
Molecular FormulaC10H21N3O3S
Molecular Weight263.36 g/mol
Exact Mass263.13
IUPAC NameN-(3-hydroxycyclohexyl)piperazine-1-sulfonamide
SMILESO=S(=O)(NC1CCCC(O)C1)N1CCNCC1
InChIInChI=1S/C10H21N3O3S/c14-10-3-1-2-9(8-10)12-17(15,16)13-6-4-11-5-7-13/h9-12,14H,1-8H2
InChIKeyUNCQTVKEPWDOPH-UHFFFAOYSA-N
XLogP-0.97
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 5-0.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxycyclohexyl)piperazine-1-sulfonamide?
The IUPAC name of N-(3-hydroxycyclohexyl)piperazine-1-sulfonamide (CID 61252359) is N-(3-hydroxycyclohexyl)piperazine-1-sulfonamide.
What is the SMILES notation for N-(3-hydroxycyclohexyl)piperazine-1-sulfonamide?
The canonical SMILES for N-(3-hydroxycyclohexyl)piperazine-1-sulfonamide is O=S(=O)(NC1CCCC(O)C1)N1CCNCC1.
What is the InChIKey of N-(3-hydroxycyclohexyl)piperazine-1-sulfonamide?
The InChIKey is UNCQTVKEPWDOPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O3S/c14-10-3-1-2-9(8-10)12-17(15,16)13-6-4-11-5-7-13/h9-12,14H,1-8H2.
What are the key properties of N-(3-hydroxycyclohexyl)piperazine-1-sulfonamide?
N-(3-hydroxycyclohexyl)piperazine-1-sulfonamide has a molecular weight of 263.36 g/mol, XLogP of -0.97, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxycyclohexyl)piperazine-1-sulfonamide is sourced from PubChem (CID 61252359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).