3-methyl-1-(1-propylpiperidin-4-yl)piperidine

C14H28N2 — CID 2846563

IUPAC3-methyl-1-(1-propylpiperidin-4-yl)piperidine
SMILESCCCN1CCC(N2CCCC(C)C2)CC1
InChIInChI=1S/C14H28N2/c1-3-8-15-10-6-14(7-11-15)16-9-4-5-13(2)12-16/h13-14H,3-12H2,1-2H3
InChIKeyJYOCLHUBQHEJPC-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.59
Rot. Bonds3

About 3-methyl-1-(1-propylpiperidin-4-yl)piperidine

3-methyl-1-(1-propylpiperidin-4-yl)piperidine (PubChem CID 2846563) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 3-methyl-1-(1-propylpiperidin-4-yl)piperidine.

Molecular Properties

Compound Name3-methyl-1-(1-propylpiperidin-4-yl)piperidine
PubChem CID2846563
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name3-methyl-1-(1-propylpiperidin-4-yl)piperidine
SMILESCCCN1CCC(N2CCCC(C)C2)CC1
InChIInChI=1S/C14H28N2/c1-3-8-15-10-6-14(7-11-15)16-9-4-5-13(2)12-16/h13-14H,3-12H2,1-2H3
InChIKeyJYOCLHUBQHEJPC-UHFFFAOYSA-N
XLogP2.59
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(1-propylpiperidin-4-yl)piperidine?
The IUPAC name of 3-methyl-1-(1-propylpiperidin-4-yl)piperidine (CID 2846563) is 3-methyl-1-(1-propylpiperidin-4-yl)piperidine.
What is the SMILES notation for 3-methyl-1-(1-propylpiperidin-4-yl)piperidine?
The canonical SMILES for 3-methyl-1-(1-propylpiperidin-4-yl)piperidine is CCCN1CCC(N2CCCC(C)C2)CC1.
What is the InChIKey of 3-methyl-1-(1-propylpiperidin-4-yl)piperidine?
The InChIKey is JYOCLHUBQHEJPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-3-8-15-10-6-14(7-11-15)16-9-4-5-13(2)12-16/h13-14H,3-12H2,1-2H3.
What are the key properties of 3-methyl-1-(1-propylpiperidin-4-yl)piperidine?
3-methyl-1-(1-propylpiperidin-4-yl)piperidine has a molecular weight of 224.39 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(1-propylpiperidin-4-yl)piperidine is sourced from PubChem (CID 2846563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).