5-pyrrolidin-1-ylsulfonylpyridin-3-amine

C9H13N3O2S — CID 82222980

IUPAC5-pyrrolidin-1-ylsulfonylpyridin-3-amine
SMILESNc1cncc(S(=O)(=O)N2CCCC2)c1
InChIInChI=1S/C9H13N3O2S/c10-8-5-9(7-11-6-8)15(13,14)12-3-1-2-4-12/h5-7H,1-4,10H2
InChIKeyKFTHRPXMPUMCSZ-UHFFFAOYSA-N
MW227.29 g/mol
LogP0.45
Rot. Bonds2

About 5-pyrrolidin-1-ylsulfonylpyridin-3-amine

5-pyrrolidin-1-ylsulfonylpyridin-3-amine (PubChem CID 82222980) has the molecular formula C9H13N3O2S and a molecular weight of 227.29 g/mol. Its IUPAC name is 5-pyrrolidin-1-ylsulfonylpyridin-3-amine.

Molecular Properties

Compound Name5-pyrrolidin-1-ylsulfonylpyridin-3-amine
PubChem CID82222980
Molecular FormulaC9H13N3O2S
Molecular Weight227.29 g/mol
Exact Mass227.07
IUPAC Name5-pyrrolidin-1-ylsulfonylpyridin-3-amine
SMILESNc1cncc(S(=O)(=O)N2CCCC2)c1
InChIInChI=1S/C9H13N3O2S/c10-8-5-9(7-11-6-8)15(13,14)12-3-1-2-4-12/h5-7H,1-4,10H2
InChIKeyKFTHRPXMPUMCSZ-UHFFFAOYSA-N
XLogP0.45
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.29
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-pyrrolidin-1-ylsulfonylpyridin-3-amine 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

3-(azepan-1-ylsulfonyl)aniline
CID 5004919
3-(azetidin-1-ylsulfonyl)aniline
CID 130546539
1-[(5,6-dichloro-3-pyridinyl)sulfonyl]azepane
CID 4730925
4-[(5-fluoro-3-pyridinyl)sulfonyl]morpholine
CID 62039673
2-chloro-5-pyrrolidin-1-ylsulfonylaniline
CID 2963514
1-[(5-fluoro-3-pyridinyl)sulfonyl]piperidine-4-carbaldehyde
CID 63844852
3-bromo-5-(3-piperidin-1-ylpyrrolidin-1-yl)sulfonylpyridine
CID 63175235
(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine
CID 114613060
1-(1H-pyrazol-4-ylsulfonyl)azepane
CID 60911155
2-[4-[(5-fluoro-3-pyridinyl)sulfonyl]-1,4-diazepan-1-yl]acetic acid
CID 62824486
5-(1,4-diazepan-1-ylsulfonyl)-N-ethylpyridin-3-amine
CID 82223030
3-chloro-2-(3,6-dihydro-2H-pyridin-1-yl)-5-pyrrolidin-1-ylsulfonylpyridine
CID 136574904

Frequently Asked Questions

What is the IUPAC name of 5-pyrrolidin-1-ylsulfonylpyridin-3-amine?
The IUPAC name of 5-pyrrolidin-1-ylsulfonylpyridin-3-amine (CID 82222980) is 5-pyrrolidin-1-ylsulfonylpyridin-3-amine.
What is the SMILES notation for 5-pyrrolidin-1-ylsulfonylpyridin-3-amine?
The canonical SMILES for 5-pyrrolidin-1-ylsulfonylpyridin-3-amine is Nc1cncc(S(=O)(=O)N2CCCC2)c1.
What is the InChIKey of 5-pyrrolidin-1-ylsulfonylpyridin-3-amine?
The InChIKey is KFTHRPXMPUMCSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2S/c10-8-5-9(7-11-6-8)15(13,14)12-3-1-2-4-12/h5-7H,1-4,10H2.
What are the key properties of 5-pyrrolidin-1-ylsulfonylpyridin-3-amine?
5-pyrrolidin-1-ylsulfonylpyridin-3-amine has a molecular weight of 227.29 g/mol, XLogP of 0.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrrolidin-1-ylsulfonylpyridin-3-amine is sourced from PubChem (CID 82222980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).