morpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone

C19H33N3O5S — CID 55683506

IUPACmorpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone
SMILESCCCS(=O)(=O)N1CCCC(C(=O)N2CCC(C(=O)N3CCOCC3)CC2)C1
InChIInChI=1S/C19H33N3O5S/c1-2-14-28(25,26)22-7-3-4-17(15-22)19(24)20-8-5-16(6-9-20)18(23)21-10-12-27-13-11-21/h16-17H,2-15H2,1H3
InChIKeyWOAJWDRYIPUFSD-UHFFFAOYSA-N
MW415.56 g/mol
LogP0.54
Rot. Bonds5

About morpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone

morpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone (PubChem CID 55683506) has the molecular formula C19H33N3O5S and a molecular weight of 415.56 g/mol. Its IUPAC name is morpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone
PubChem CID55683506
Molecular FormulaC19H33N3O5S
Molecular Weight415.56 g/mol
Exact Mass415.21
IUPAC Namemorpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone
SMILESCCCS(=O)(=O)N1CCCC(C(=O)N2CCC(C(=O)N3CCOCC3)CC2)C1
InChIInChI=1S/C19H33N3O5S/c1-2-14-28(25,26)22-7-3-4-17(15-22)19(24)20-8-5-16(6-9-20)18(23)21-10-12-27-13-11-21/h16-17H,2-15H2,1H3
InChIKeyWOAJWDRYIPUFSD-UHFFFAOYSA-N
XLogP0.54
TPSA87.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.56
LogP ≤ 50.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

cyclopropyl-[4-(1-propylsulfonylpiperidine-3-carbonyl)piperazin-1-yl]methanone
CID 55682841
morpholin-4-yl-[(3R)-1-(1-propylsulfonylpiperidin-4-yl)piperidin-3-yl]methanone
CID 96573725
[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]-(1-propylsulfonylpiperidin-3-yl)methanone
CID 55685244
morpholin-4-yl-[1-(3-phenylpropylsulfonyl)piperidin-3-yl]methanone
CID 46770435
azepan-1-yl-(1-morpholin-4-ylsulfonylpiperidin-3-yl)methanone
CID 22552707
N-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]benzamide
CID 42959145
[1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-3-yl]-morpholin-4-ylmethanone
CID 55511986
[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(1-propylsulfonylpiperidin-3-yl)methanone
CID 46489746
1-[4-(1-propylsulfonylpiperidine-4-carbonyl)piperazin-1-yl]ethanone
CID 113003864
morpholin-4-yl-[1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperidin-3-yl]methanone
CID 16605464
(4-morpholin-4-ylsulfonylpiperazin-1-yl)-(1-propylsulfonylpyrrolidin-2-yl)methanone
CID 55563956
2-[4-(1-ethylsulfonylpiperidine-3-carbonyl)morpholin-2-yl]acetic acid
CID 119248008

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone?
The IUPAC name of morpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone (CID 55683506) is morpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone?
The canonical SMILES for morpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone is CCCS(=O)(=O)N1CCCC(C(=O)N2CCC(C(=O)N3CCOCC3)CC2)C1.
What is the InChIKey of morpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone?
The InChIKey is WOAJWDRYIPUFSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33N3O5S/c1-2-14-28(25,26)22-7-3-4-17(15-22)19(24)20-8-5-16(6-9-20)18(23)21-10-12-27-13-11-21/h16-17H,2-15H2,1H3.
What are the key properties of morpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone?
morpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone has a molecular weight of 415.56 g/mol, XLogP of 0.54, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[1-(1-propylsulfonylpiperidine-3-carbonyl)piperidin-4-yl]methanone is sourced from PubChem (CID 55683506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).