(4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine

C11H24N4O2S — CID 80506150

IUPAC(4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine
SMILESCN1CCN(S(=O)(=O)N2CCCCC2)C(CN)C1
InChIInChI=1S/C11H24N4O2S/c1-13-7-8-15(11(9-12)10-13)18(16,17)14-5-3-2-4-6-14/h11H,2-10,12H2,1H3
InChIKeyYUUGJXUAUQAZKM-UHFFFAOYSA-N
MW276.41 g/mol
LogP-0.71
Rot. Bonds3

About (4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine

(4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine (PubChem CID 80506150) has the molecular formula C11H24N4O2S and a molecular weight of 276.41 g/mol. Its IUPAC name is (4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine.

Molecular Properties

Compound Name(4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine
PubChem CID80506150
Molecular FormulaC11H24N4O2S
Molecular Weight276.41 g/mol
Exact Mass276.16
IUPAC Name(4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine
SMILESCN1CCN(S(=O)(=O)N2CCCCC2)C(CN)C1
InChIInChI=1S/C11H24N4O2S/c1-13-7-8-15(11(9-12)10-13)18(16,17)14-5-3-2-4-6-14/h11H,2-10,12H2,1H3
InChIKeyYUUGJXUAUQAZKM-UHFFFAOYSA-N
XLogP-0.71
TPSA69.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.41
LogP ≤ 5-0.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(azepan-1-ylsulfonyl)piperidin-2-yl]methanamine;hydrochloride
CID 119969168
[1-(1,1-dioxothian-4-yl)sulfonyl-4-methylpiperazin-2-yl]methanamine
CID 80506096
[4-methyl-1-(oxan-4-ylsulfonyl)piperazin-2-yl]methanamine
CID 80505945
2-(aminomethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperazine-1-sulfonamide
CID 114811162
1-(4-methyl-2-phenylpiperazin-1-yl)sulfonylazepane
CID 43042480
(4-methyl-1-thiophen-2-ylsulfonylpiperazin-2-yl)methanamine
CID 80505797
[4-methyl-1-(2-methylphenyl)sulfonylpiperazin-2-yl]methanamine
CID 80506021
[(2R,3R)-1-(azepan-1-ylsulfonyl)-3-methylpiperidin-2-yl]methanamine
CID 124835693
[4-methyl-1-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]piperazin-2-yl]methanamine
CID 80506146
(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)methanamine
CID 43605338
1-(1-piperidin-1-ylsulfonylazepan-2-yl)propan-2-ol
CID 79560533
1-(1-piperidin-1-ylsulfonylpyrrolidin-2-yl)propan-2-ol
CID 79545984

Frequently Asked Questions

What is the IUPAC name of (4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine?
The IUPAC name of (4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine (CID 80506150) is (4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine.
What is the SMILES notation for (4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine?
The canonical SMILES for (4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine is CN1CCN(S(=O)(=O)N2CCCCC2)C(CN)C1.
What is the InChIKey of (4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine?
The InChIKey is YUUGJXUAUQAZKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O2S/c1-13-7-8-15(11(9-12)10-13)18(16,17)14-5-3-2-4-6-14/h11H,2-10,12H2,1H3.
What are the key properties of (4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine?
(4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine has a molecular weight of 276.41 g/mol, XLogP of -0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-1-piperidin-1-ylsulfonylpiperazin-2-yl)methanamine is sourced from PubChem (CID 80506150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).