4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride

C11H24Cl2N2 — CID 57445880

IUPAC4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride
SMILESCC1CCCN1CC1CCNCC1.Cl.Cl
InChIInChI=1S/C11H22N2.2ClH/c1-10-3-2-8-13(10)9-11-4-6-12-7-5-11;;/h10-12H,2-9H2,1H3;2*1H
InChIKeyWYMFZMMQAXDDJC-UHFFFAOYSA-N
MW255.23 g/mol
LogP2.31
Rot. Bonds2

About 4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride

4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride (PubChem CID 57445880) has the molecular formula C11H24Cl2N2 and a molecular weight of 255.23 g/mol. Its IUPAC name is 4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride.

Molecular Properties

Compound Name4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride
PubChem CID57445880
Molecular FormulaC11H24Cl2N2
Molecular Weight255.23 g/mol
Exact Mass254.13
IUPAC Name4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride
SMILESCC1CCCN1CC1CCNCC1.Cl.Cl
InChIInChI=1S/C11H22N2.2ClH/c1-10-3-2-8-13(10)9-11-4-6-12-7-5-11;;/h10-12H,2-9H2,1H3;2*1H
InChIKeyWYMFZMMQAXDDJC-UHFFFAOYSA-N
XLogP2.31
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.23
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-1-(pyrrolidin-3-ylmethyl)piperidine;dihydrochloride
CID 56831717
5-methyl-4-(piperidin-4-ylmethyl)-1,4-thiazepane 1,1-dioxide;hydrochloride
CID 120857963
4-[(2-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine
CID 60973462
2-methyl-1-(piperidin-4-ylmethyl)piperazine;propane
CID 156712071
2,4-dimethyl-1-(piperidin-4-ylmethyl)piperazine;2-methylpropane
CID 165137195
4-methyl-1-(piperidin-4-ylmethyl)azepane;hydrochloride
CID 119930987
[3-[(2-methylpiperidin-1-yl)methyl]piperidin-1-yl]-pyrrolidin-3-ylmethanone;dihydrochloride
CID 119867686
1,2,3-trimethyl-4-(piperidin-4-ylmethyl)piperazine
CID 120854846
1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride
CID 18770386
7-methyl-1-[(1-methylsulfonylpiperidin-3-yl)methyl]-1,4-diazepane
CID 79622838
4-[[2-(4-methylphenyl)pyrrolidin-1-yl]methyl]piperidine
CID 119930010
[(3R)-3-[[(2R)-2-methylpiperidin-1-yl]methyl]piperidin-1-yl]-[(3R)-pyrrolidin-3-yl]methanone
CID 125120891

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride?
The IUPAC name of 4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride (CID 57445880) is 4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride.
What is the SMILES notation for 4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride?
The canonical SMILES for 4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride is CC1CCCN1CC1CCNCC1.Cl.Cl.
What is the InChIKey of 4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride?
The InChIKey is WYMFZMMQAXDDJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2.2ClH/c1-10-3-2-8-13(10)9-11-4-6-12-7-5-11;;/h10-12H,2-9H2,1H3;2*1H.
What are the key properties of 4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride?
4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride has a molecular weight of 255.23 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylpyrrolidin-1-yl)methyl]piperidine;dihydrochloride is sourced from PubChem (CID 57445880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).