N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride

C8H20ClN3O2S — CID 119910084

IUPACN-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride
SMILESCS(=O)(=O)NCCN1CCCC(N)C1.Cl
InChIInChI=1S/C8H19N3O2S.ClH/c1-14(12,13)10-4-6-11-5-2-3-8(9)7-11;/h8,10H,2-7,9H2,1H3;1H
InChIKeyQEKVZCICYFMXLO-UHFFFAOYSA-N
MW257.79 g/mol
LogP-0.62
Rot. Bonds4

About N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride

N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride (PubChem CID 119910084) has the molecular formula C8H20ClN3O2S and a molecular weight of 257.79 g/mol. Its IUPAC name is N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride
PubChem CID119910084
Molecular FormulaC8H20ClN3O2S
Molecular Weight257.79 g/mol
Exact Mass257.10
IUPAC NameN-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride
SMILESCS(=O)(=O)NCCN1CCCC(N)C1.Cl
InChIInChI=1S/C8H19N3O2S.ClH/c1-14(12,13)10-4-6-11-5-2-3-8(9)7-11;/h8,10H,2-7,9H2,1H3;1H
InChIKeyQEKVZCICYFMXLO-UHFFFAOYSA-N
XLogP-0.62
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.79
LogP ≤ 5-0.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride 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

N-[2-[3-(aminomethyl)piperidin-1-yl]ethyl]methanesulfonamide;hydrochloride
CID 119915689
N-[2-[(3S)-3-methylsulfanylazepan-1-yl]ethyl]methanesulfonamide
CID 97238803
N-[2-(3-methylsulfanylazepan-1-yl)ethyl]methanesulfonamide
CID 84591017
1-(2-methylsulfonylethyl)azepan-3-amine
CID 84686145
N-[2-[(4aR,8aR)-1-cyclopropyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl]ethyl]methanesulfonamide
CID 97238808
(3S)-1-[6-(methylamino)hexyl]piperidin-3-amine
CID 175905935
N-[2-[3-(methylamino)piperidin-1-yl]ethyl]ethanesulfonamide;hydrochloride
CID 119920149
N-[2-(2,3,4,4a,5,7,8,8a-octahydropyrano[3,2-c]pyridin-6-yl)ethyl]methanesulfonamide
CID 75469233
N-[1-[3-(methanesulfonamido)propyl]piperidin-3-yl]acetamide
CID 86842614
1-(2-bromoethyl)piperidin-3-amine
CID 130905726
2-(3-aminopiperidin-1-yl)ethanol
CID 61296854
N-[2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)ethyl]methanesulfonamide
CID 62738613

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride?
The IUPAC name of N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride (CID 119910084) is N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride.
What is the SMILES notation for N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride?
The canonical SMILES for N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride is CS(=O)(=O)NCCN1CCCC(N)C1.Cl.
What is the InChIKey of N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride?
The InChIKey is QEKVZCICYFMXLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O2S.ClH/c1-14(12,13)10-4-6-11-5-2-3-8(9)7-11;/h8,10H,2-7,9H2,1H3;1H.
What are the key properties of N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride?
N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride has a molecular weight of 257.79 g/mol, XLogP of -0.62, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-aminopiperidin-1-yl)ethyl]methanesulfonamide;hydrochloride is sourced from PubChem (CID 119910084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).