N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide

C13H26N4O3S — CID 61252931

IUPACN-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide
SMILESCCCC(=O)NC1CCN(S(=O)(=O)N2CCNCC2)CC1
InChIInChI=1S/C13H26N4O3S/c1-2-3-13(18)15-12-4-8-16(9-5-12)21(19,20)17-10-6-14-7-11-17/h12,14H,2-11H2,1H3,(H,15,18)
InChIKeyCERMZQYLIRPZCC-UHFFFAOYSA-N
MW318.44 g/mol
LogP-0.48
Rot. Bonds5

About N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide

N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide (PubChem CID 61252931) has the molecular formula C13H26N4O3S and a molecular weight of 318.44 g/mol. Its IUPAC name is N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide.

Molecular Properties

Compound NameN-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide
PubChem CID61252931
Molecular FormulaC13H26N4O3S
Molecular Weight318.44 g/mol
Exact Mass318.17
IUPAC NameN-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide
SMILESCCCC(=O)NC1CCN(S(=O)(=O)N2CCNCC2)CC1
InChIInChI=1S/C13H26N4O3S/c1-2-3-13(18)15-12-4-8-16(9-5-12)21(19,20)17-10-6-14-7-11-17/h12,14H,2-11H2,1H3,(H,15,18)
InChIKeyCERMZQYLIRPZCC-UHFFFAOYSA-N
XLogP-0.48
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.44
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide 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

N-[1-(benzenesulfonyl)piperidin-4-yl]butanamide
CID 61073647
4-oxo-4-[(1-propylsulfonylpiperidin-4-yl)amino]butanoic acid
CID 60940483
N-[1-[3-(ethylamino)propanoyl]piperidin-4-yl]butanamide
CID 62835122
N-[1-(3-methylpiperidine-3-carbonyl)piperidin-4-yl]butanamide
CID 63131758
N-[1-[2-(methylamino)acetyl]piperidin-4-yl]butanamide
CID 54871655
5-[(1-ethylsulfonylpiperidin-4-yl)amino]-5-oxopentanoic acid
CID 60942022
N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide
CID 54871679
N-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]butanamide
CID 103809389
N-[1-[(2R)-2-aminopropanoyl]piperidin-4-yl]butanamide
CID 54996241
3-(ethylamino)-N-(1-ethylsulfonylpiperidin-4-yl)propanamide
CID 62834981
N-(1-methylpyrrolidin-3-yl)butanamide
CID 18723360
N-cyclooctylbutanamide
CID 4614062

Frequently Asked Questions

What is the IUPAC name of N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide?
The IUPAC name of N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide (CID 61252931) is N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide.
What is the SMILES notation for N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide?
The canonical SMILES for N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide is CCCC(=O)NC1CCN(S(=O)(=O)N2CCNCC2)CC1.
What is the InChIKey of N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide?
The InChIKey is CERMZQYLIRPZCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4O3S/c1-2-3-13(18)15-12-4-8-16(9-5-12)21(19,20)17-10-6-14-7-11-17/h12,14H,2-11H2,1H3,(H,15,18).
What are the key properties of N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide?
N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide has a molecular weight of 318.44 g/mol, XLogP of -0.48, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-piperazin-1-ylsulfonylpiperidin-4-yl)butanamide is sourced from PubChem (CID 61252931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).