4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine

C12H23N3O4S — CID 108567103

IUPAC4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine
SMILESCC(=O)CCC(=O)N1CCC(NS(=O)(=O)N(C)C)CC1
InChIInChI=1S/C12H23N3O4S/c1-10(16)4-5-12(17)15-8-6-11(7-9-15)13-20(18,19)14(2)3/h11,13H,4-9H2,1-3H3
InChIKeyCGLMOLFFMACDHD-UHFFFAOYSA-N
MW305.40 g/mol
LogP-0.26
Rot. Bonds6

About 4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine

4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine (PubChem CID 108567103) has the molecular formula C12H23N3O4S and a molecular weight of 305.40 g/mol. Its IUPAC name is 4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine.

Molecular Properties

Compound Name4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine
PubChem CID108567103
Molecular FormulaC12H23N3O4S
Molecular Weight305.40 g/mol
Exact Mass305.14
IUPAC Name4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine
SMILESCC(=O)CCC(=O)N1CCC(NS(=O)(=O)N(C)C)CC1
InChIInChI=1S/C12H23N3O4S/c1-10(16)4-5-12(17)15-8-6-11(7-9-15)13-20(18,19)14(2)3/h11,13H,4-9H2,1-3H3
InChIKeyCGLMOLFFMACDHD-UHFFFAOYSA-N
XLogP-0.26
TPSA86.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 5-0.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-oxopentanoyl)piperidin-4-yl]ethanesulfonamide
CID 65415873
2-[3-[4-(dimethylsulfamoylamino)piperidin-1-yl]-3-oxopropyl]-1,3-dioxoisoindole
CID 108564716
1-(cyclopentanecarbonyl)-4-(dimethylsulfamoylamino)piperidine
CID 110820008
2-[2-[4-(dimethylsulfamoylamino)piperidin-1-yl]-2-oxoethyl]-1,3-dioxoisoindole
CID 108564651
N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide
CID 110819565
methyl N-[1-(4-oxopentanoyl)piperidin-4-yl]carbamate
CID 108567119
N-(1-butanoylpiperidin-4-yl)methanesulfonamide
CID 60708278
methyl 4-[4-(methanesulfonamido)piperidin-1-yl]-4-oxobutanoate
CID 110819832
methyl 4-[4-(ethylsulfonylamino)piperidin-1-yl]-4-oxobutanoate
CID 110819833
1-[2-(4-chloro-3,5-dimethylphenoxy)acetyl]-4-(dimethylsulfamoylamino)piperidine
CID 108565003
1-[2-(2,3-dimethylphenoxy)acetyl]-4-(dimethylsulfamoylamino)piperidine
CID 108565042
N-[1-(6-aminohexanoyl)piperidin-4-yl]methanesulfonamide
CID 54870016

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine?
The IUPAC name of 4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine (CID 108567103) is 4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine.
What is the SMILES notation for 4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine?
The canonical SMILES for 4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine is CC(=O)CCC(=O)N1CCC(NS(=O)(=O)N(C)C)CC1.
What is the InChIKey of 4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine?
The InChIKey is CGLMOLFFMACDHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O4S/c1-10(16)4-5-12(17)15-8-6-11(7-9-15)13-20(18,19)14(2)3/h11,13H,4-9H2,1-3H3.
What are the key properties of 4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine?
4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine has a molecular weight of 305.40 g/mol, XLogP of -0.26, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoylamino)-1-(4-oxopentanoyl)piperidine is sourced from PubChem (CID 108567103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).