2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine

C11H18N4O2S — CID 113024377

IUPAC2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine
SMILESCN(C)S(=O)(=O)Nc1ccc(N2CCCC2)cn1
InChIInChI=1S/C11H18N4O2S/c1-14(2)18(16,17)13-11-6-5-10(9-12-11)15-7-3-4-8-15/h5-6,9H,3-4,7-8H2,1-2H3,(H,12,13)
InChIKeySIEJLBLFXHROBS-UHFFFAOYSA-N
MW270.36 g/mol
LogP0.90
Rot. Bonds4

About 2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine

2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine (PubChem CID 113024377) has the molecular formula C11H18N4O2S and a molecular weight of 270.36 g/mol. Its IUPAC name is 2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine.

Molecular Properties

Compound Name2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine
PubChem CID113024377
Molecular FormulaC11H18N4O2S
Molecular Weight270.36 g/mol
Exact Mass270.12
IUPAC Name2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine
SMILESCN(C)S(=O)(=O)Nc1ccc(N2CCCC2)cn1
InChIInChI=1S/C11H18N4O2S/c1-14(2)18(16,17)13-11-6-5-10(9-12-11)15-7-3-4-8-15/h5-6,9H,3-4,7-8H2,1-2H3,(H,12,13)
InChIKeySIEJLBLFXHROBS-UHFFFAOYSA-N
XLogP0.90
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[6-(dimethylsulfamoylamino)-3-pyridinyl]-4-(4-fluorophenyl)piperazine
CID 113028878
1-(2,3-dimethylphenyl)-4-[6-(dimethylsulfamoylamino)-3-pyridinyl]piperazine
CID 113029435
1-[4-(dimethylsulfamoylamino)phenyl]piperidine
CID 110756594
3,4-dimethyl-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzenesulfonamide
CID 113024384
N-[5-(azepan-1-yl)-2-pyridinyl]-2,4,6-trimethylbenzenesulfonamide
CID 113031108
N-[5-(azepan-1-yl)-2-pyridinyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 113031132
3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine
CID 113039016
N-propan-2-yl-5-pyrrolidin-1-ylpyridin-2-amine
CID 115917830
N-[5-(azepan-1-yl)-2-pyridinyl]-2-methoxy-4,5-dimethylbenzenesulfonamide
CID 113031119
4-fluoro-3-methyl-N-(5-piperidin-1-yl-2-pyridinyl)benzenesulfonamide
CID 113024649
3-chloro-2-methyl-N-(5-piperidin-1-yl-2-pyridinyl)benzenesulfonamide
CID 68842273
4-methoxy-2,5-dimethyl-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzenesulfonamide
CID 113024403

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine?
The IUPAC name of 2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine (CID 113024377) is 2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine.
What is the SMILES notation for 2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine?
The canonical SMILES for 2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine is CN(C)S(=O)(=O)Nc1ccc(N2CCCC2)cn1.
What is the InChIKey of 2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine?
The InChIKey is SIEJLBLFXHROBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2S/c1-14(2)18(16,17)13-11-6-5-10(9-12-11)15-7-3-4-8-15/h5-6,9H,3-4,7-8H2,1-2H3,(H,12,13).
What are the key properties of 2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine?
2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine has a molecular weight of 270.36 g/mol, XLogP of 0.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine is sourced from PubChem (CID 113024377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).