3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine

C22H44N4 — CID 69469025

IUPAC3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine
SMILESCC1CCCN(CCCN2CCN(CCCN3CC(C)CC(C)C3)C2)C1
InChIInChI=1S/C22H44N4/c1-20-7-4-8-23(16-20)9-5-10-24-13-14-25(19-24)11-6-12-26-17-21(2)15-22(3)18-26/h20-22H,4-19H2,1-3H3
InChIKeyVLWBXZRASSWHDM-UHFFFAOYSA-N
MW364.62 g/mol
LogP3.05
Rot. Bonds8

About 3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine

3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine (PubChem CID 69469025) has the molecular formula C22H44N4 and a molecular weight of 364.62 g/mol. Its IUPAC name is 3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine.

Molecular Properties

Compound Name3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine
PubChem CID69469025
Molecular FormulaC22H44N4
Molecular Weight364.62 g/mol
Exact Mass364.36
IUPAC Name3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine
SMILESCC1CCCN(CCCN2CCN(CCCN3CC(C)CC(C)C3)C2)C1
InChIInChI=1S/C22H44N4/c1-20-7-4-8-23(16-20)9-5-10-24-13-14-25(19-24)11-6-12-26-17-21(2)15-22(3)18-26/h20-22H,4-19H2,1-3H3
InChIKeyVLWBXZRASSWHDM-UHFFFAOYSA-N
XLogP3.05
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.62
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine?
The IUPAC name of 3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine (CID 69469025) is 3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine.
What is the SMILES notation for 3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine?
The canonical SMILES for 3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine is CC1CCCN(CCCN2CCN(CCCN3CC(C)CC(C)C3)C2)C1.
What is the InChIKey of 3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine?
The InChIKey is VLWBXZRASSWHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H44N4/c1-20-7-4-8-23(16-20)9-5-10-24-13-14-25(19-24)11-6-12-26-17-21(2)15-22(3)18-26/h20-22H,4-19H2,1-3H3.
What are the key properties of 3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine?
3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine has a molecular weight of 364.62 g/mol, XLogP of 3.05, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1-[3-[3-[3-(3-methylpiperidin-1-yl)propyl]imidazolidin-1-yl]propyl]piperidine is sourced from PubChem (CID 69469025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).