2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine

C15H30N2 — CID 104595182

IUPAC2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine
SMILESCCC1(CC)CCN(CC2(C)CCCCN2)C1
InChIInChI=1S/C15H30N2/c1-4-15(5-2)9-11-17(13-15)12-14(3)8-6-7-10-16-14/h16H,4-13H2,1-3H3
InChIKeyRHXKRZZXGIEQAF-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.03
Rot. Bonds4

About 2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine

2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine (PubChem CID 104595182) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine.

Molecular Properties

Compound Name2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine
PubChem CID104595182
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine
SMILESCCC1(CC)CCN(CC2(C)CCCCN2)C1
InChIInChI=1S/C15H30N2/c1-4-15(5-2)9-11-17(13-15)12-14(3)8-6-7-10-16-14/h16H,4-13H2,1-3H3
InChIKeyRHXKRZZXGIEQAF-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-[(2-methylpiperidin-2-yl)methyl]-8-azaspiro[4.5]decane
CID 113430623
1-methyl-4-[(2-methylpiperidin-2-yl)methyl]-1,4-diazepane
CID 104594729
4-[(2-methylpiperidin-2-yl)methyl]morpholine
CID 104594654
N,N-dimethyl-1-[(2-methylpiperidin-2-yl)methyl]piperidin-4-amine
CID 104594786
1-butan-2-yl-4-[(2-methylpiperidin-2-yl)methyl]piperazine
CID 104595017
2-[(4-ethoxypiperidin-1-yl)methyl]-2-methylpiperidine
CID 113430577
1-[(2-methylpiperidin-2-yl)methyl]-3,6-dihydro-2H-pyridine
CID 114410563
4-[(2-methylpiperidin-2-yl)methyl]-1,4-oxazepane
CID 104595033
N,N-dimethyl-1-[(2-methylpiperidin-2-yl)methyl]pyrrolidin-3-amine
CID 104595053
2-ethyl-4-[(2-methylpiperidin-2-yl)methyl]morpholine
CID 104594775
2-[(2-methylpiperidin-2-yl)methyl]-1,3-dihydroisoindole
CID 104595002
3-[(2-methylpiperidin-2-yl)methyl]-8-oxa-3-azabicyclo[3.2.1]octane
CID 104595156

Frequently Asked Questions

What is the IUPAC name of 2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine?
The IUPAC name of 2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine (CID 104595182) is 2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine.
What is the SMILES notation for 2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine?
The canonical SMILES for 2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine is CCC1(CC)CCN(CC2(C)CCCCN2)C1.
What is the InChIKey of 2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine?
The InChIKey is RHXKRZZXGIEQAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-15(5-2)9-11-17(13-15)12-14(3)8-6-7-10-16-14/h16H,4-13H2,1-3H3.
What are the key properties of 2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine?
2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine has a molecular weight of 238.42 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine is sourced from PubChem (CID 104595182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).