1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine

C11H17N3O2S — CID 71644242

IUPAC1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine
SMILESNC1CCCN(S(=O)(=O)Cc2ccccn2)C1
InChIInChI=1S/C11H17N3O2S/c12-10-4-3-7-14(8-10)17(15,16)9-11-5-1-2-6-13-11/h1-2,5-6,10H,3-4,7-9,12H2
InChIKeyRSLPCNINOLNUDE-UHFFFAOYSA-N
MW255.34 g/mol
LogP0.33
Rot. Bonds3

About 1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine

1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine (PubChem CID 71644242) has the molecular formula C11H17N3O2S and a molecular weight of 255.34 g/mol. Its IUPAC name is 1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine.

Molecular Properties

Compound Name1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine
PubChem CID71644242
Molecular FormulaC11H17N3O2S
Molecular Weight255.34 g/mol
Exact Mass255.10
IUPAC Name1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine
SMILESNC1CCCN(S(=O)(=O)Cc2ccccn2)C1
InChIInChI=1S/C11H17N3O2S/c12-10-4-3-7-14(8-10)17(15,16)9-11-5-1-2-6-13-11/h1-2,5-6,10H,3-4,7-9,12H2
InChIKeyRSLPCNINOLNUDE-UHFFFAOYSA-N
XLogP0.33
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-1-pyridin-2-ylsulfonylpiperidin-3-amine
CID 86331837
(3S)-1-(pyridin-4-ylmethylsulfonyl)piperidin-3-amine
CID 97165359
(3S)-1-(pyridin-2-ylmethyl)piperidin-3-amine
CID 39221497
3-methyl-1-(pyridin-2-ylmethylsulfonyl)piperazine;hydrochloride
CID 71639477
2-[2-[3-(chloromethyl)piperidin-1-yl]sulfonylethyl]pyridine
CID 63397714
2-[(1-pyrrolidin-1-ylsulfonylpiperidin-3-yl)methyl]pyridine
CID 110096214
2-[2-[3-(2-chloroethyl)piperidin-1-yl]sulfonylethyl]pyridine
CID 63400545
1-(2-pyridin-2-ylethylsulfonyl)piperidin-4-amine
CID 60864901
1-[(3,4-dichlorophenyl)methylsulfonyl]piperidin-3-amine;hydrochloride
CID 119959718
1-[(3-methylphenyl)methylsulfonyl]piperidin-3-amine;hydrochloride
CID 119959520
(3R)-1-benzylsulfonyl-N-(2-pyridin-2-ylethyl)piperidine-3-carboxamide
CID 1445005
1-pyridin-2-ylsulfonylpyrrolidin-3-amine;hydrochloride
CID 91660222

Frequently Asked Questions

What is the IUPAC name of 1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine?
The IUPAC name of 1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine (CID 71644242) is 1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine.
What is the SMILES notation for 1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine?
The canonical SMILES for 1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine is NC1CCCN(S(=O)(=O)Cc2ccccn2)C1.
What is the InChIKey of 1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine?
The InChIKey is RSLPCNINOLNUDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2S/c12-10-4-3-7-14(8-10)17(15,16)9-11-5-1-2-6-13-11/h1-2,5-6,10H,3-4,7-9,12H2.
What are the key properties of 1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine?
1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine has a molecular weight of 255.34 g/mol, XLogP of 0.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(pyridin-2-ylmethylsulfonyl)piperidin-3-amine is sourced from PubChem (CID 71644242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).