piperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone

C13H24N2O — CID 106974101

IUPACpiperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone
SMILESCCCC1(C(=O)N2CCCCC2)CCCN1
InChIInChI=1S/C13H24N2O/c1-2-7-13(8-6-9-14-13)12(16)15-10-4-3-5-11-15/h14H,2-11H2,1H3
InChIKeyKMELMHXFGHPYHG-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.92
Rot. Bonds3

About piperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone

piperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone (PubChem CID 106974101) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is piperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone.

Molecular Properties

Compound Namepiperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone
PubChem CID106974101
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Namepiperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone
SMILESCCCC1(C(=O)N2CCCCC2)CCCN1
InChIInChI=1S/C13H24N2O/c1-2-7-13(8-6-9-14-13)12(16)15-10-4-3-5-11-15/h14H,2-11H2,1H3
InChIKeyKMELMHXFGHPYHG-UHFFFAOYSA-N
XLogP1.92
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 ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of piperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone?
The IUPAC name of piperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone (CID 106974101) is piperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone.
What is the SMILES notation for piperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone?
The canonical SMILES for piperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone is CCCC1(C(=O)N2CCCCC2)CCCN1.
What is the InChIKey of piperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone?
The InChIKey is KMELMHXFGHPYHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-2-7-13(8-6-9-14-13)12(16)15-10-4-3-5-11-15/h14H,2-11H2,1H3.
What are the key properties of piperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone?
piperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone has a molecular weight of 224.35 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-1-yl-(2-propylpyrrolidin-2-yl)methanone is sourced from PubChem (CID 106974101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).