(2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone

C13H24N2O — CID 115887042

IUPAC(2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone
SMILESCCC1CCC(C)N1C(=O)N1CCCCC1
InChIInChI=1S/C13H24N2O/c1-3-12-8-7-11(2)15(12)13(16)14-9-5-4-6-10-14/h11-12H,3-10H2,1-2H3
InChIKeyFFLZIUXTRRPZSX-UHFFFAOYSA-N
MW224.35 g/mol
LogP2.86
Rot. Bonds1

About (2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone

(2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone (PubChem CID 115887042) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is (2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone
PubChem CID115887042
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name(2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone
SMILESCCC1CCC(C)N1C(=O)N1CCCCC1
InChIInChI=1S/C13H24N2O/c1-3-12-8-7-11(2)15(12)13(16)14-9-5-4-6-10-14/h11-12H,3-10H2,1-2H3
InChIKeyFFLZIUXTRRPZSX-UHFFFAOYSA-N
XLogP2.86
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2-ethyl-5-methylpyrrolidin-1-yl)-piperazin-1-ylmethanone
CID 83227698
3-ethyl-1-(2-ethyl-5-methylpyrrolidine-1-carbonyl)piperidine-3-carboxylic acid
CID 83219396
[(2S,5R)-2-[2-[4-(methoxymethyl)phenyl]ethyl]-5-methylpyrrolidin-1-yl]-piperidin-1-ylmethanone
CID 70897416
(2R)-1-(2-ethyl-5-methylpyrrolidin-1-yl)-2-hydroxypropan-1-one
CID 131155812
azetidin-3-yl-(2-ethyl-5-methylpyrrolidin-1-yl)methanone
CID 83227277
(2S,5S)-5-methyl-1-(pyrrolidine-1-carbonyl)pyrrolidine-2-carbonitrile
CID 11148450
(2-aminocycloheptyl)-(2-ethyl-5-methylpyrrolidin-1-yl)methanone
CID 83227366
N-cyclobutyl-2-ethyl-5-methylpyrrolidine-1-carboxamide
CID 115888716
(2,6-dimethylpiperazin-1-yl)-piperidin-1-ylmethanone
CID 79155469
cyclohexyl-(2-ethyl-5-methylpyrrolidin-1-yl)methanimine
CID 83221974
1-(2-ethyl-5-methylpyrrolidin-1-yl)-2-[1-(methylamino)cyclohexyl]ethanone
CID 83227370
N'-amino-2-ethyl-5-methylpyrrolidine-1-carboximidamide
CID 83219973

Frequently Asked Questions

What is the IUPAC name of (2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone?
The IUPAC name of (2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone (CID 115887042) is (2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone is CCC1CCC(C)N1C(=O)N1CCCCC1.
What is the InChIKey of (2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone?
The InChIKey is FFLZIUXTRRPZSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-3-12-8-7-11(2)15(12)13(16)14-9-5-4-6-10-14/h11-12H,3-10H2,1-2H3.
What are the key properties of (2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone?
(2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone has a molecular weight of 224.35 g/mol, XLogP of 2.86, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-5-methylpyrrolidin-1-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 115887042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).