N,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide

C12H25N3O2S — CID 25219516

IUPACN,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC(C2CCNCC2)CC1
InChIInChI=1S/C12H25N3O2S/c1-14(2)18(16,17)15-9-5-12(6-10-15)11-3-7-13-8-4-11/h11-13H,3-10H2,1-2H3
InChIKeyJYTHYCMPNRDNOL-UHFFFAOYSA-N
MW275.42 g/mol
LogP0.50
Rot. Bonds3

About N,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide

N,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide (PubChem CID 25219516) has the molecular formula C12H25N3O2S and a molecular weight of 275.42 g/mol. Its IUPAC name is N,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide
PubChem CID25219516
Molecular FormulaC12H25N3O2S
Molecular Weight275.42 g/mol
Exact Mass275.17
IUPAC NameN,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC(C2CCNCC2)CC1
InChIInChI=1S/C12H25N3O2S/c1-14(2)18(16,17)15-9-5-12(6-10-15)11-3-7-13-8-4-11/h11-13H,3-10H2,1-2H3
InChIKeyJYTHYCMPNRDNOL-UHFFFAOYSA-N
XLogP0.50
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,4'-Bipiperidine
CID 736050
Piperazine, 1-((4-methyl-1-piperidinyl)sulfonyl)-
CID 6458546
1-Pentyl-4-piperidin-4-ylpiperidine
CID 44592882
1-Methyl-4,4'-bipiperidine
CID 7183041
1-(Methylsulfonyl)-4,4'-bipiperidine
CID 4778260
4-Piperidin-1-ium-4-ylpiperidin-1-ium
CID 5245633
3-Methyl-4-(3-methylpiperidin-4-yl)piperidine
CID 14123198
1-Ethyl-4,4'-bipiperidine
CID 18321027
4-(1-Piperidin-4-ylpropyl)piperidine
CID 19706505
2-(2-Piperidin-4-ylpropyl)thiazinane 1,1-dioxide
CID 20434891
2-(4-Piperidylmethyl)-5-methyltetrahydro-1,2,6-thiadiazine-1,1-dioxide
CID 20434894
2-(Piperidin-4-ylmethyl)-1,2,6-thiadiazinane 1,1-dioxide
CID 20434896

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide?
The IUPAC name of N,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide (CID 25219516) is N,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide.
What is the SMILES notation for N,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide?
The canonical SMILES for N,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide is CN(C)S(=O)(=O)N1CCC(C2CCNCC2)CC1.
What is the InChIKey of N,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide?
The InChIKey is JYTHYCMPNRDNOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2S/c1-14(2)18(16,17)15-9-5-12(6-10-15)11-3-7-13-8-4-11/h11-13H,3-10H2,1-2H3.
What are the key properties of N,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide?
N,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide has a molecular weight of 275.42 g/mol, XLogP of 0.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-piperidin-4-ylpiperidine-1-sulfonamide is sourced from PubChem (CID 25219516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).