1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride

C10H17Cl2N3O2S — CID 165437566

IUPAC1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride
SMILESCl.Cl.NC1CCCN(S(=O)(=O)c2cccnc2)C1
InChIInChI=1S/C10H15N3O2S.2ClH/c11-9-3-2-6-13(8-9)16(14,15)10-4-1-5-12-7-10;;/h1,4-5,7,9H,2-3,6,8,11H2;2*1H
InChIKeyBKBURESLYSKQCF-UHFFFAOYSA-N
MW314.24 g/mol
LogP1.04
Rot. Bonds2

About 1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride

1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride (PubChem CID 165437566) has the molecular formula C10H17Cl2N3O2S and a molecular weight of 314.24 g/mol. Its IUPAC name is 1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride.

Molecular Properties

Compound Name1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride
PubChem CID165437566
Molecular FormulaC10H17Cl2N3O2S
Molecular Weight314.24 g/mol
Exact Mass313.04
IUPAC Name1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride
SMILESCl.Cl.NC1CCCN(S(=O)(=O)c2cccnc2)C1
InChIInChI=1S/C10H15N3O2S.2ClH/c11-9-3-2-6-13(8-9)16(14,15)10-4-1-5-12-7-10;;/h1,4-5,7,9H,2-3,6,8,11H2;2*1H
InChIKeyBKBURESLYSKQCF-UHFFFAOYSA-N
XLogP1.04
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.24
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride 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

(3R)-1-pyridin-3-ylsulfonylpyrrolidin-3-amine;hydrochloride
CID 119962668
(1-pyridin-3-ylsulfonylpiperidin-3-yl)methanamine;hydrochloride
CID 119968968
3-(3-isocyanatopiperidin-1-yl)sulfonylpyridine
CID 24706355
3-(3-pyrrolidin-2-ylpiperidin-1-yl)sulfonylpyridine
CID 60977763
(3R)-N-methyl-1-pyridin-3-ylsulfonylpiperidine-3-carboxamide
CID 95828955
N-[(1-pyridin-3-ylsulfonylpiperidin-3-yl)methyl]propan-1-amine
CID 63879976
N-(2-aminoethyl)-1-pyridin-3-ylsulfonylpiperidine-3-carboxamide
CID 63253265
3-[(1-pyridin-3-ylsulfonylpyrrolidin-3-yl)methyl]pyridine
CID 166622070
2-methyl-6-[(3R)-1-pyridin-3-ylsulfonylpiperidin-3-yl]pyrazine
CID 125024782
3-[4-(bromomethyl)piperidin-1-yl]sulfonylpyridine
CID 80668698
(3S)-1-pyridin-2-ylsulfonylpiperidin-3-amine
CID 86331837
3-(4-bromopiperidin-1-yl)sulfonylpyridine
CID 80672721

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride?
The IUPAC name of 1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride (CID 165437566) is 1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride.
What is the SMILES notation for 1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride?
The canonical SMILES for 1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride is Cl.Cl.NC1CCCN(S(=O)(=O)c2cccnc2)C1.
What is the InChIKey of 1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride?
The InChIKey is BKBURESLYSKQCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2S.2ClH/c11-9-3-2-6-13(8-9)16(14,15)10-4-1-5-12-7-10;;/h1,4-5,7,9H,2-3,6,8,11H2;2*1H.
What are the key properties of 1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride?
1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride has a molecular weight of 314.24 g/mol, XLogP of 1.04, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-3-ylsulfonylpiperidin-3-amine;dihydrochloride is sourced from PubChem (CID 165437566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).