(3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride

C9H14ClN3O2S — CID 119962668

IUPAC(3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride
SMILESCl.N[C@@H]1CCN(S(=O)(=O)c2cccnc2)C1
InChIInChI=1S/C9H13N3O2S.ClH/c10-8-3-5-12(7-8)15(13,14)9-2-1-4-11-6-9;/h1-2,4,6,8H,3,5,7,10H2;1H/t8-;/m1./s1
InChIKeySRWYKIVCZBHORZ-DDWIOCJRSA-N
MW263.75 g/mol
LogP0.23
Rot. Bonds2

About (3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride

(3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride (PubChem CID 119962668) has the molecular formula C9H14ClN3O2S and a molecular weight of 263.75 g/mol. Its IUPAC name is (3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride.

Molecular Properties

Compound Name(3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride
PubChem CID119962668
Molecular FormulaC9H14ClN3O2S
Molecular Weight263.75 g/mol
Exact Mass263.05
IUPAC Name(3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride
SMILESCl.N[C@@H]1CCN(S(=O)(=O)c2cccnc2)C1
InChIInChI=1S/C9H13N3O2S.ClH/c10-8-3-5-12(7-8)15(13,14)9-2-1-4-11-6-9;/h1-2,4,6,8H,3,5,7,10H2;1H/t8-;/m1./s1
InChIKeySRWYKIVCZBHORZ-DDWIOCJRSA-N
XLogP0.23
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.75
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride
CID 165437566
(1-pyridin-3-ylsulfonylpiperidin-3-yl)methanamine;hydrochloride
CID 119968968
3-[(1-pyridin-3-ylsulfonylpyrrolidin-3-yl)methyl]pyridine
CID 166622070
3-[4-(bromomethyl)piperidin-1-yl]sulfonylpyridine
CID 80668698
3-(4-bromopiperidin-1-yl)sulfonylpyridine
CID 80672721
1-isoquinolin-6-ylsulfonylpyrrolidin-3-amine;dihydrochloride
CID 66727171
(3R)-1-(1-phenylpyrazol-4-yl)sulfonylpyrrolidin-3-amine;hydrochloride
CID 119962892
1-(3-chlorophenyl)sulfonylpyrrolidin-3-amine;hydrochloride
CID 119971605
(3S)-1-(3-chlorophenyl)sulfonylpyrrolidin-3-amine;hydrochloride
CID 119993468
1-pyridin-3-ylsulfonylazetidin-3-ol
CID 63105318
1-isoquinolin-5-ylsulfonylpyrrolidin-3-amine;hydrochloride
CID 119971621
1-pyridin-3-ylsulfonyl-6-(trifluoromethyl)piperidin-3-amine;hydrochloride
CID 167932026

Frequently Asked Questions

What is the IUPAC name of (3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride?
The IUPAC name of (3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride (CID 119962668) is (3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride.
What is the SMILES notation for (3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride?
The canonical SMILES for (3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride is Cl.N[C@@H]1CCN(S(=O)(=O)c2cccnc2)C1.
What is the InChIKey of (3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride?
The InChIKey is SRWYKIVCZBHORZ-DDWIOCJRSA-N. The full InChI is InChI=1S/C9H13N3O2S.ClH/c10-8-3-5-12(7-8)15(13,14)9-2-1-4-11-6-9;/h1-2,4,6,8H,3,5,7,10H2;1H/t8-;/m1./s1.
What are the key properties of (3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride?
(3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride has a molecular weight of 263.75 g/mol, XLogP of 0.23, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride is sourced from PubChem (CID 119962668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).