2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide

C15H30N4O4S — CID 42949638

IUPAC2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)CN1CCN(S(=O)(=O)N2CCOCC2)CC1
InChIInChI=1S/C15H30N4O4S/c1-3-4-14(2)16-15(20)13-17-5-7-18(8-6-17)24(21,22)19-9-11-23-12-10-19/h14H,3-13H2,1-2H3,(H,16,20)
InChIKeyWAPZRVJRRIMARD-UHFFFAOYSA-N
MW362.50 g/mol
LogP-0.51
Rot. Bonds7

About 2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide

2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide (PubChem CID 42949638) has the molecular formula C15H30N4O4S and a molecular weight of 362.50 g/mol. Its IUPAC name is 2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide.

Molecular Properties

Compound Name2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide
PubChem CID42949638
Molecular FormulaC15H30N4O4S
Molecular Weight362.50 g/mol
Exact Mass362.20
IUPAC Name2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)CN1CCN(S(=O)(=O)N2CCOCC2)CC1
InChIInChI=1S/C15H30N4O4S/c1-3-4-14(2)16-15(20)13-17-5-7-18(8-6-17)24(21,22)19-9-11-23-12-10-19/h14H,3-13H2,1-2H3,(H,16,20)
InChIKeyWAPZRVJRRIMARD-UHFFFAOYSA-N
XLogP-0.51
TPSA82.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.50
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(Morpholin-4-yl)-2-(piperazin-1-yl)propan-1-one
CID 16769381
2-[3-(methanesulfonamido)piperidin-1-yl]-N-(2-methoxyethyl)acetamide
CID 53509564
N-(2-methoxyethyl)-2-(4-piperidin-1-ylpiperidin-1-yl)acetamide
CID 3229545
2-morpholin-4-yl-N-[5-(2-morpholin-4-ylacetylamino)pentyl]acetamide
CID 3715658
N-(2-methylbutan-2-yl)-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide
CID 36933060
4-(2,6-Dimethylmorpholin-4-yl)sulfonylpiperazin-2-one
CID 42936453
N-butan-2-yl-2-[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]acetamide
CID 45872572
N-{2-[(3S)-3-ethylmorpholin-4-yl]-2-oxoethyl}-N-methylpiperidin-4-amine
CID 70754523
2-Morpholin-4-yl-1-piperazin-1-ylpropan-1-one
CID 24693653
2-(2-Methylpiperazin-1-yl)-1-morpholin-4-ylethanone
CID 58735477
2-[4-(Methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone
CID 60818068
1-(3-Aminopiperidin-1-yl)-2-morpholin-4-ylethanone
CID 71012901

Frequently Asked Questions

What is the IUPAC name of 2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide?
The IUPAC name of 2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide (CID 42949638) is 2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide.
What is the SMILES notation for 2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide?
The canonical SMILES for 2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide is CCCC(C)NC(=O)CN1CCN(S(=O)(=O)N2CCOCC2)CC1.
What is the InChIKey of 2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide?
The InChIKey is WAPZRVJRRIMARD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O4S/c1-3-4-14(2)16-15(20)13-17-5-7-18(8-6-17)24(21,22)19-9-11-23-12-10-19/h14H,3-13H2,1-2H3,(H,16,20).
What are the key properties of 2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide?
2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide has a molecular weight of 362.50 g/mol, XLogP of -0.51, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-N-pentan-2-ylacetamide is sourced from PubChem (CID 42949638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).