N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride

C11H24ClN3 — CID 131086453

IUPACN-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride
SMILESCNCC1CCCN1C1CCCNC1.Cl
InChIInChI=1S/C11H23N3.ClH/c1-12-8-10-5-3-7-14(10)11-4-2-6-13-9-11;/h10-13H,2-9H2,1H3;1H
InChIKeyLOYOWSHTBKDHBP-UHFFFAOYSA-N
MW233.79 g/mol
LogP0.84
Rot. Bonds3

About N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride

N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride (PubChem CID 131086453) has the molecular formula C11H24ClN3 and a molecular weight of 233.79 g/mol. Its IUPAC name is N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride
PubChem CID131086453
Molecular FormulaC11H24ClN3
Molecular Weight233.79 g/mol
Exact Mass233.17
IUPAC NameN-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride
SMILESCNCC1CCCN1C1CCCNC1.Cl
InChIInChI=1S/C11H23N3.ClH/c1-12-8-10-5-3-7-14(10)11-4-2-6-13-9-11;/h10-13H,2-9H2,1H3;1H
InChIKeyLOYOWSHTBKDHBP-UHFFFAOYSA-N
XLogP0.84
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.79
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Aminomethyl-1-ethylpyrrolidine
CID 117295
3-amino-N-ethylpiperidine
CID 98094
1-Pentylpiperazine
CID 2737112
3-Methyl-octahydropyrrolo(1,2-a)piperazine
CID 18958803
4-(1-Pyrrolidinyl)piperidine
CID 78703
3-(Pyrrolidin-1-yl)piperidine
CID 573611
(S)-(-)-2-Aminomethyl-1-ethylpyrrolidine
CID 643457
(2R)-1-Ethyl-2-pyrrolidinemethanamine
CID 854138
1-Cyclopentylpiperazine
CID 806421
Methyl(2-(piperidin-1-yl)ethyl)amine
CID 3157473
(S)-N-Ethyl-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 7141622
1-(Pyrrolidin-3-yl)piperidine
CID 23009617

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride?
The IUPAC name of N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride (CID 131086453) is N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride.
What is the SMILES notation for N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride?
The canonical SMILES for N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride is CNCC1CCCN1C1CCCNC1.Cl.
What is the InChIKey of N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride?
The InChIKey is LOYOWSHTBKDHBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3.ClH/c1-12-8-10-5-3-7-14(10)11-4-2-6-13-9-11;/h10-13H,2-9H2,1H3;1H.
What are the key properties of N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride?
N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride has a molecular weight of 233.79 g/mol, XLogP of 0.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride is sourced from PubChem (CID 131086453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).