N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide

C13H26N2O3S — CID 110819565

IUPACN-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide
SMILESCCCCC(=O)N1CCC(NS(=O)(=O)CCC)CC1
InChIInChI=1S/C13H26N2O3S/c1-3-5-6-13(16)15-9-7-12(8-10-15)14-19(17,18)11-4-2/h12,14H,3-11H2,1-2H3
InChIKeyNJZCEBGPMDPTAK-UHFFFAOYSA-N
MW290.43 g/mol
LogP1.50
Rot. Bonds7

About N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide

N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide (PubChem CID 110819565) has the molecular formula C13H26N2O3S and a molecular weight of 290.43 g/mol. Its IUPAC name is N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide.

Molecular Properties

Compound NameN-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide
PubChem CID110819565
Molecular FormulaC13H26N2O3S
Molecular Weight290.43 g/mol
Exact Mass290.17
IUPAC NameN-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide
SMILESCCCCC(=O)N1CCC(NS(=O)(=O)CCC)CC1
InChIInChI=1S/C13H26N2O3S/c1-3-5-6-13(16)15-9-7-12(8-10-15)14-19(17,18)11-4-2/h12,14H,3-11H2,1-2H3
InChIKeyNJZCEBGPMDPTAK-UHFFFAOYSA-N
XLogP1.50
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.43
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3-cyclohexylpropanoyl)piperidin-4-yl]butane-1-sulfonamide
CID 108566173
N-[1-(4-oxopentanoyl)piperidin-4-yl]ethanesulfonamide
CID 65415873
N-[1-(3-phenylpropanoyl)piperidin-4-yl]butane-1-sulfonamide
CID 108566076
N-[1-[4-(1,3-dioxoisoindol-2-yl)butanoyl]piperidin-4-yl]butane-1-sulfonamide
CID 108566307
N-[1-(3-aminobutanoyl)piperidin-4-yl]propane-1-sulfonamide
CID 119732749
N-(1-butanoylpiperidin-4-yl)methanesulfonamide
CID 60708278
methyl 4-[4-(ethylsulfonylamino)piperidin-1-yl]-4-oxobutanoate
CID 110819833
1-[4-(methylamino)piperidin-1-yl]hexan-1-one
CID 60818219
4-(butylsulfonylamino)-N-(2,2-dimethylpropyl)piperidine-1-carboxamide
CID 110822591
4-chloro-N-(1-pentanoylpiperidin-4-yl)benzenesulfonamide
CID 108566133
2-methyl-N-(1-pentanoylpiperidin-4-yl)benzenesulfonamide
CID 110819574
2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide
CID 110819505

Frequently Asked Questions

What is the IUPAC name of N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide?
The IUPAC name of N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide (CID 110819565) is N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide.
What is the SMILES notation for N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide?
The canonical SMILES for N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide is CCCCC(=O)N1CCC(NS(=O)(=O)CCC)CC1.
What is the InChIKey of N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide?
The InChIKey is NJZCEBGPMDPTAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3S/c1-3-5-6-13(16)15-9-7-12(8-10-15)14-19(17,18)11-4-2/h12,14H,3-11H2,1-2H3.
What are the key properties of N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide?
N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide has a molecular weight of 290.43 g/mol, XLogP of 1.50, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide is sourced from PubChem (CID 110819565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).