[(2S)-piperidin-2-yl]methanamine;dihydrochloride

C6H16Cl2N2 — CID 134690845

IUPAC[(2S)-piperidin-2-yl]methanamine;dihydrochloride
SMILESCl.Cl.NC[C@@H]1CCCCN1
InChIInChI=1S/C6H14N2.2ClH/c7-5-6-3-1-2-4-8-6;;/h6,8H,1-5,7H2;2*1H/t6-;;/m0../s1
InChIKeyJUKUSTRJUDKWDY-ILKKLZGPSA-N
MW187.11 g/mol
LogP0.93
Rot. Bonds1

About [(2S)-piperidin-2-yl]methanamine;dihydrochloride

[(2S)-piperidin-2-yl]methanamine;dihydrochloride (PubChem CID 134690845) has the molecular formula C6H16Cl2N2 and a molecular weight of 187.11 g/mol. Its IUPAC name is [(2S)-piperidin-2-yl]methanamine;dihydrochloride.

Molecular Properties

Compound Name[(2S)-piperidin-2-yl]methanamine;dihydrochloride
PubChem CID134690845
Molecular FormulaC6H16Cl2N2
Molecular Weight187.11 g/mol
Exact Mass186.07
IUPAC Name[(2S)-piperidin-2-yl]methanamine;dihydrochloride
SMILESCl.Cl.NC[C@@H]1CCCCN1
InChIInChI=1S/C6H14N2.2ClH/c7-5-6-3-1-2-4-8-6;;/h6,8H,1-5,7H2;2*1H/t6-;;/m0../s1
InChIKeyJUKUSTRJUDKWDY-ILKKLZGPSA-N
XLogP0.93
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.11
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [(2S)-piperidin-2-yl]methanamine;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

[(2R)-piperidin-2-yl]methanamine;hydrochloride
CID 70654045
2-pyrrolidin-2-ylethanamine
CID 14030009
[(2S)-azepan-2-yl]methanol;hydrochloride
CID 163198382
(2S)-2-[3-[(2S)-piperidin-2-yl]propyl]piperidine
CID 29416072
(2R)-2-[3-[(2R)-piperidin-2-yl]propyl]piperidine
CID 29416085
CID 176937281
CID 176937281
2-[(2S)-piperidin-2-yl]ethanol;hydrochloride
CID 53487138
2-ethylpiperidine;hydrobromide
CID 131717239
2-(fluoromethyl)azocane
CID 170142115
[(2S)-azepan-2-yl]methanol
CID 870731
N,N-dimethyl-1-piperidin-2-ylmethanamine;dihydrochloride
CID 45075192
(2R)-2-(cyclobutylmethyl)piperidine
CID 99737651

Frequently Asked Questions

What is the IUPAC name of [(2S)-piperidin-2-yl]methanamine;dihydrochloride?
The IUPAC name of [(2S)-piperidin-2-yl]methanamine;dihydrochloride (CID 134690845) is [(2S)-piperidin-2-yl]methanamine;dihydrochloride.
What is the SMILES notation for [(2S)-piperidin-2-yl]methanamine;dihydrochloride?
The canonical SMILES for [(2S)-piperidin-2-yl]methanamine;dihydrochloride is Cl.Cl.NC[C@@H]1CCCCN1.
What is the InChIKey of [(2S)-piperidin-2-yl]methanamine;dihydrochloride?
The InChIKey is JUKUSTRJUDKWDY-ILKKLZGPSA-N. The full InChI is InChI=1S/C6H14N2.2ClH/c7-5-6-3-1-2-4-8-6;;/h6,8H,1-5,7H2;2*1H/t6-;;/m0../s1.
What are the key properties of [(2S)-piperidin-2-yl]methanamine;dihydrochloride?
[(2S)-piperidin-2-yl]methanamine;dihydrochloride has a molecular weight of 187.11 g/mol, XLogP of 0.93, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-piperidin-2-yl]methanamine;dihydrochloride is sourced from PubChem (CID 134690845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).