1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine

C12H24N2 — CID 5042776

IUPAC1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine
SMILESCC1CCNC1CCN1CCCCC1
InChIInChI=1S/C12H24N2/c1-11-5-7-13-12(11)6-10-14-8-3-2-4-9-14/h11-13H,2-10H2,1H3
InChIKeyIXEUSAKGMQNEQU-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.86
Rot. Bonds3

About 1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine

1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine (PubChem CID 5042776) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine.

Molecular Properties

Compound Name1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine
PubChem CID5042776
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine
SMILESCC1CCNC1CCN1CCCCC1
InChIInChI=1S/C12H24N2/c1-11-5-7-13-12(11)6-10-14-8-3-2-4-9-14/h11-13H,2-10H2,1H3
InChIKeyIXEUSAKGMQNEQU-UHFFFAOYSA-N
XLogP1.86
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-4-[(3-methylpyrrolidin-2-yl)methyl]-1,4-diazepane
CID 102775567
2-(3-methylpyrrolidin-2-yl)ethanol
CID 55286766
5-methyl-1-(2-piperidin-1-ylethyl)-1,4-diazepane
CID 82242425
1-[(2-methylpyrrolidin-3-yl)methyl]azocane
CID 79385329
2-[(3-methylpyrrolidin-2-yl)methyl]-2-azaspiro[4.5]decane
CID 114279344
1-[(3-methylpyrrolidin-2-yl)methyl]-4-propylpiperidine
CID 102775923
1-[(3-ethylpyrrolidin-2-yl)methyl]piperidine
CID 3445538
[(2S,3R)-3-methylpyrrolidin-2-yl]methanol
CID 66599997
1-[(3-methylpyrrolidin-2-yl)methyl]-2,5-dihydropyrrole
CID 126996409
1-(2-cyclopropylethyl)pyrrolidine
CID 67632943
ethane;(3-methylpyrrolidin-2-yl)methanamine
CID 177053684
3-methyl-1-(2-pyrrolidin-1-ylethyl)piperazine
CID 65448835

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine?
The IUPAC name of 1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine (CID 5042776) is 1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine.
What is the SMILES notation for 1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine?
The canonical SMILES for 1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine is CC1CCNC1CCN1CCCCC1.
What is the InChIKey of 1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine?
The InChIKey is IXEUSAKGMQNEQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-11-5-7-13-12(11)6-10-14-8-3-2-4-9-14/h11-13H,2-10H2,1H3.
What are the key properties of 1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine?
1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine has a molecular weight of 196.34 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine is sourced from PubChem (CID 5042776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).