[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone

C16H23N3O5S — CID 119678670

IUPAC[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone
SMILESCOc1ccc(S(=O)(=O)N2CCN(C(=O)C3COCCN3)CC2)cc1
InChIInChI=1S/C16H23N3O5S/c1-23-13-2-4-14(5-3-13)25(21,22)19-9-7-18(8-10-19)16(20)15-12-24-11-6-17-15/h2-5,15,17H,6-12H2,1H3
InChIKeyPJMJDNAHTRVJHQ-UHFFFAOYSA-N
MW369.44 g/mol
LogP-0.48
Rot. Bonds4

About [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone

[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone (PubChem CID 119678670) has the molecular formula C16H23N3O5S and a molecular weight of 369.44 g/mol. Its IUPAC name is [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone.

Molecular Properties

Compound Name[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone
PubChem CID119678670
Molecular FormulaC16H23N3O5S
Molecular Weight369.44 g/mol
Exact Mass369.14
IUPAC Name[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone
SMILESCOc1ccc(S(=O)(=O)N2CCN(C(=O)C3COCCN3)CC2)cc1
InChIInChI=1S/C16H23N3O5S/c1-23-13-2-4-14(5-3-13)25(21,22)19-9-7-18(8-10-19)16(20)15-12-24-11-6-17-15/h2-5,15,17H,6-12H2,1H3
InChIKeyPJMJDNAHTRVJHQ-UHFFFAOYSA-N
XLogP-0.48
TPSA88.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.44
LogP ≤ 5-0.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-morpholin-3-ylmethanone;hydrochloride
CID 119687775
[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-[(1S,2R)-2-methylcyclopropyl]methanone
CID 9496499
[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride
CID 119678710
2-[4-(4-methoxyphenyl)sulfonylpiperazine-1-carbonyl]cyclopropane-1-carboxylic acid
CID 119179393
[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-morpholin-3-ylmethanone
CID 119694698
[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-(3-methylpiperazin-1-yl)methanone;hydrochloride
CID 119576431
cyclopropyl-[2-[4-(4-methoxyphenyl)sulfonylpiperazine-1-carbonyl]pyrrolidin-1-yl]methanone
CID 55630204
[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-pyrrolidin-2-ylmethanone
CID 119265303
1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2,2-dimethylpropan-1-one
CID 17191308
[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone;hydrochloride
CID 119730727
1-[(3R)-3-[4-(4-methoxyphenyl)sulfonylpiperazine-1-carbonyl]piperidin-1-yl]ethanone
CID 9326800
N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]morpholine-3-carboxamide;hydrochloride
CID 119699477

Frequently Asked Questions

What is the IUPAC name of [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone?
The IUPAC name of [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone (CID 119678670) is [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone.
What is the SMILES notation for [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone?
The canonical SMILES for [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone is COc1ccc(S(=O)(=O)N2CCN(C(=O)C3COCCN3)CC2)cc1.
What is the InChIKey of [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone?
The InChIKey is PJMJDNAHTRVJHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O5S/c1-23-13-2-4-14(5-3-13)25(21,22)19-9-7-18(8-10-19)16(20)15-12-24-11-6-17-15/h2-5,15,17H,6-12H2,1H3.
What are the key properties of [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone?
[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone has a molecular weight of 369.44 g/mol, XLogP of -0.48, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-morpholin-3-ylmethanone is sourced from PubChem (CID 119678670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).