3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol

C10H21N3O3S — CID 114679039

IUPAC3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol
SMILESCC1CN(S(=O)(=O)N2CCNCC2)CCC1O
InChIInChI=1S/C10H21N3O3S/c1-9-8-13(5-2-10(9)14)17(15,16)12-6-3-11-4-7-12/h9-11,14H,2-8H2,1H3
InChIKeyJVAWQHXYFFVOFW-UHFFFAOYSA-N
MW263.36 g/mol
LogP-1.16
Rot. Bonds2

About 3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol

3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol (PubChem CID 114679039) has the molecular formula C10H21N3O3S and a molecular weight of 263.36 g/mol. Its IUPAC name is 3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol.

Molecular Properties

Compound Name3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol
PubChem CID114679039
Molecular FormulaC10H21N3O3S
Molecular Weight263.36 g/mol
Exact Mass263.13
IUPAC Name3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol
SMILESCC1CN(S(=O)(=O)N2CCNCC2)CCC1O
InChIInChI=1S/C10H21N3O3S/c1-9-8-13(5-2-10(9)14)17(15,16)12-6-3-11-4-7-12/h9-11,14H,2-8H2,1H3
InChIKeyJVAWQHXYFFVOFW-UHFFFAOYSA-N
XLogP-1.16
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 5-1.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 1-(4-hydroxy-3-methylpiperidin-1-yl)sulfonylpiperidine-4-carboxylate
CID 114680638
3-methyl-1-pyrrolidin-3-ylsulfonylpiperidin-4-ol
CID 114683822
1-(1-piperazin-1-ylsulfonylpyrrolidin-3-yl)ethanol
CID 112626102
1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride
CID 119961883
1-piperazin-1-ylsulfonylazetidin-3-ol;hydrochloride
CID 138039753
1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylpiperazine
CID 28775925
1,2-dimethyl-4-piperazin-1-ylsulfonylpiperazine
CID 63608690
2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride
CID 119961532
N-tert-butyl-4-hydroxy-3-methylpiperidine-1-sulfonamide
CID 114809879
N,N-diethyl-4-hydroxy-3-methylpiperidine-1-sulfonamide
CID 114501631
(3S,4S)-3-methyl-1-piperidin-4-ylpiperidin-4-ol
CID 129381092
3-(1,4-diazepan-1-ylsulfonyl)-9-methyl-3,9-diazabicyclo[4.2.1]nonane
CID 79174228

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol?
The IUPAC name of 3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol (CID 114679039) is 3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol.
What is the SMILES notation for 3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol?
The canonical SMILES for 3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol is CC1CN(S(=O)(=O)N2CCNCC2)CCC1O.
What is the InChIKey of 3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol?
The InChIKey is JVAWQHXYFFVOFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O3S/c1-9-8-13(5-2-10(9)14)17(15,16)12-6-3-11-4-7-12/h9-11,14H,2-8H2,1H3.
What are the key properties of 3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol?
3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol has a molecular weight of 263.36 g/mol, XLogP of -1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-piperazin-1-ylsulfonylpiperidin-4-ol is sourced from PubChem (CID 114679039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).