piperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone

C13H24N2O — CID 115734206

IUPACpiperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone
SMILESCCCC1CCN(C(=O)C2CCCNC2)C1
InChIInChI=1S/C13H24N2O/c1-2-4-11-6-8-15(10-11)13(16)12-5-3-7-14-9-12/h11-12,14H,2-10H2,1H3
InChIKeyXXHDXKMKXIFMPG-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.63
Rot. Bonds3

About piperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone

piperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone (PubChem CID 115734206) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is piperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Namepiperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone
PubChem CID115734206
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Namepiperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone
SMILESCCCC1CCN(C(=O)C2CCCNC2)C1
InChIInChI=1S/C13H24N2O/c1-2-4-11-6-8-15(10-11)13(16)12-5-3-7-14-9-12/h11-12,14H,2-10H2,1H3
InChIKeyXXHDXKMKXIFMPG-UHFFFAOYSA-N
XLogP1.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

piperidin-3-yl-(3-propylpiperidin-1-yl)methanone;hydrochloride
CID 119337253
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-piperidin-3-ylmethanone
CID 114797503
[(3R)-3-(ethoxymethyl)pyrrolidin-1-yl]-[(3R)-piperidin-3-yl]methanone
CID 129380230
(4-ethylpiperidin-1-yl)-[(3S)-piperidin-3-yl]methanone
CID 81129798
[3-[[methyl(propyl)amino]methyl]pyrrolidin-1-yl]-piperidin-3-ylmethanone
CID 119895885
[3-(ethoxymethyl)pyrrolidin-1-yl]-piperidin-3-ylmethanone;hydrochloride
CID 119341197
piperidin-3-yl-[3-(piperidin-1-ylmethyl)pyrrolidin-1-yl]methanone;dihydrochloride
CID 119894675
[4-[(dimethylamino)methyl]piperidin-1-yl]-piperidin-3-ylmethanone
CID 54874476
(2-methylpiperidin-4-yl)-(3-propylpyrrolidin-1-yl)methanone
CID 106740610
pyrrolidin-3-yl-[3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone
CID 119892585
3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl(piperidin-3-yl)methanone
CID 43620377
azepan-1-yl-[(3S)-piperidin-3-yl]methanone
CID 7169846

Frequently Asked Questions

What is the IUPAC name of piperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone?
The IUPAC name of piperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone (CID 115734206) is piperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone.
What is the SMILES notation for piperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone?
The canonical SMILES for piperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone is CCCC1CCN(C(=O)C2CCCNC2)C1.
What is the InChIKey of piperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone?
The InChIKey is XXHDXKMKXIFMPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-2-4-11-6-8-15(10-11)13(16)12-5-3-7-14-9-12/h11-12,14H,2-10H2,1H3.
What are the key properties of piperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone?
piperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone has a molecular weight of 224.35 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-3-yl-(3-propylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 115734206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).