4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine

C14H28N4O3S — CID 166272653

IUPAC4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine
SMILESCN1CCN(S(=O)(=O)N2CCC(N3CCOCC3)CC2)CC1
InChIInChI=1S/C14H28N4O3S/c1-15-6-8-18(9-7-15)22(19,20)17-4-2-14(3-5-17)16-10-12-21-13-11-16/h14H,2-13H2,1H3
InChIKeySVVNYAGRYQPJAP-UHFFFAOYSA-N
MW332.47 g/mol
LogP-0.72
Rot. Bonds3

About 4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine

4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine (PubChem CID 166272653) has the molecular formula C14H28N4O3S and a molecular weight of 332.47 g/mol. Its IUPAC name is 4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine
PubChem CID166272653
Molecular FormulaC14H28N4O3S
Molecular Weight332.47 g/mol
Exact Mass332.19
IUPAC Name4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine
SMILESCN1CCN(S(=O)(=O)N2CCC(N3CCOCC3)CC2)CC1
InChIInChI=1S/C14H28N4O3S/c1-15-6-8-18(9-7-15)22(19,20)17-4-2-14(3-5-17)16-10-12-21-13-11-16/h14H,2-13H2,1H3
InChIKeySVVNYAGRYQPJAP-UHFFFAOYSA-N
XLogP-0.72
TPSA56.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.47
LogP ≤ 5-0.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine
CID 142483010
4-cyclopropylmorpholine;ethane
CID 155594914
1-methyl-4-[4-[(3S)-3-methylpyrrolidin-1-yl]sulfonylpiperazin-1-yl]sulfonylpiperazine
CID 97260419
4-morpholin-4-ylpiperidine-1-carbonyl chloride
CID 15700344
4-methylmorpholine;sulfuric acid
CID 146295231
lithium;4-methylmorpholine;chloride
CID 172748649
1-methyl-3-(1-morpholin-4-ylsulfonylpiperidin-4-yl)-2λ6,1,3-benzothiadiazole 2,2-dioxide
CID 119103189
1-cyclopropylsulfonyl-4-methylpiperazine
CID 59576558
4-[(4-morpholin-4-ylsulfonyl-1,4-diazepan-1-yl)sulfonyl]morpholine
CID 1258870
ethane;1-methyl-4-(1-methylpiperidin-4-yl)piperazine
CID 144911273
ethane;4-morpholin-4-ylpiperidine-1-carbaldehyde
CID 142506557
4-[1-(2-chlorophenyl)sulfonylpiperidin-4-yl]morpholine
CID 11950053

Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine?
The IUPAC name of 4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine (CID 166272653) is 4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine.
What is the SMILES notation for 4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine?
The canonical SMILES for 4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine is CN1CCN(S(=O)(=O)N2CCC(N3CCOCC3)CC2)CC1.
What is the InChIKey of 4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine?
The InChIKey is SVVNYAGRYQPJAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O3S/c1-15-6-8-18(9-7-15)22(19,20)17-4-2-14(3-5-17)16-10-12-21-13-11-16/h14H,2-13H2,1H3.
What are the key properties of 4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine?
4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine has a molecular weight of 332.47 g/mol, XLogP of -0.72, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine is sourced from PubChem (CID 166272653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).