4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine

C10H22N4O2S — CID 140652133

IUPAC4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine
SMILESCS(=O)(=O)N1CCN(C2CCNCC2N)CC1
InChIInChI=1S/C10H22N4O2S/c1-17(15,16)14-6-4-13(5-7-14)10-2-3-12-8-9(10)11/h9-10,12H,2-8,11H2,1H3
InChIKeyOEUWUWRXYNFITD-UHFFFAOYSA-N
MW262.38 g/mol
LogP-1.75
Rot. Bonds2

About 4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine

4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine (PubChem CID 140652133) has the molecular formula C10H22N4O2S and a molecular weight of 262.38 g/mol. Its IUPAC name is 4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine.

Molecular Properties

Compound Name4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine
PubChem CID140652133
Molecular FormulaC10H22N4O2S
Molecular Weight262.38 g/mol
Exact Mass262.15
IUPAC Name4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine
SMILESCS(=O)(=O)N1CCN(C2CCNCC2N)CC1
InChIInChI=1S/C10H22N4O2S/c1-17(15,16)14-6-4-13(5-7-14)10-2-3-12-8-9(10)11/h9-10,12H,2-8,11H2,1H3
InChIKeyOEUWUWRXYNFITD-UHFFFAOYSA-N
XLogP-1.75
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 5-1.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(Piperidin-3-yl)-1lambda6,2-thiazinane-1,1-dione
CID 83821944
N-methyl-N-{2-[(1-methylpiperidin-4-yl)amino]ethyl}methanesulfonamide
CID 50954696
N-[2-[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]ethyl]methanesulfonamide
CID 75431194
1-(3-amino-5-fluoropiperidin-4-yl)-N,N-dimethylpiperidine-4-sulfonamide
CID 123725074
3,3-difluoro-N-(1-methylsulfonylpiperidin-4-yl)piperidin-4-amine
CID 178689166
N-[2-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]ethyl]methanesulfonamide
CID 43771877
1-Methylsulfonyl-4-piperidin-4-yl-1,4-diazepane
CID 20613831
N-(1-propylpiperidin-4-yl)methanesulfonamide
CID 21328012
N-Methyl-1-(methylsulfonyl)piperidin-3-amine
CID 21983816
N-(1-ethylpiperidin-4-yl)methanesulfonamide
CID 22772589
N-(1-Isopropylpiperidin-4-yl)methanesulfonamide
CID 22772686
1-[1-(Methylsulfonyl)-4-piperidinyl]piperazine
CID 28270710

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine?
The IUPAC name of 4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine (CID 140652133) is 4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine.
What is the SMILES notation for 4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine?
The canonical SMILES for 4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine is CS(=O)(=O)N1CCN(C2CCNCC2N)CC1.
What is the InChIKey of 4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine?
The InChIKey is OEUWUWRXYNFITD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4O2S/c1-17(15,16)14-6-4-13(5-7-14)10-2-3-12-8-9(10)11/h9-10,12H,2-8,11H2,1H3.
What are the key properties of 4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine?
4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine has a molecular weight of 262.38 g/mol, XLogP of -1.75, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylsulfonylpiperazin-1-yl)piperidin-3-amine is sourced from PubChem (CID 140652133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).