4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine

C26H50N4O — CID 130295884

IUPAC4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine
SMILESCC1CCN(C2CCN(C(C)(C)C(C)(C)N3CCC(N4CCOCC4)CC3)CC2)CC1
InChIInChI=1S/C26H50N4O/c1-22-6-12-27(13-7-22)23-8-14-29(15-9-23)25(2,3)26(4,5)30-16-10-24(11-17-30)28-18-20-31-21-19-28/h22-24H,6-21H2,1-5H3
InChIKeyUOVFVTQPMOEXLR-UHFFFAOYSA-N
MW434.71 g/mol
LogP3.54
Rot. Bonds5

About 4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine

4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine (PubChem CID 130295884) has the molecular formula C26H50N4O and a molecular weight of 434.71 g/mol. Its IUPAC name is 4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine
PubChem CID130295884
Molecular FormulaC26H50N4O
Molecular Weight434.71 g/mol
Exact Mass434.40
IUPAC Name4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine
SMILESCC1CCN(C2CCN(C(C)(C)C(C)(C)N3CCC(N4CCOCC4)CC3)CC2)CC1
InChIInChI=1S/C26H50N4O/c1-22-6-12-27(13-7-22)23-8-14-29(15-9-23)25(2,3)26(4,5)30-16-10-24(11-17-30)28-18-20-31-21-19-28/h22-24H,6-21H2,1-5H3
InChIKeyUOVFVTQPMOEXLR-UHFFFAOYSA-N
XLogP3.54
TPSA22.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.71
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine?
The IUPAC name of 4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine (CID 130295884) is 4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine.
What is the SMILES notation for 4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine?
The canonical SMILES for 4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine is CC1CCN(C2CCN(C(C)(C)C(C)(C)N3CCC(N4CCOCC4)CC3)CC2)CC1.
What is the InChIKey of 4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine?
The InChIKey is UOVFVTQPMOEXLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H50N4O/c1-22-6-12-27(13-7-22)23-8-14-29(15-9-23)25(2,3)26(4,5)30-16-10-24(11-17-30)28-18-20-31-21-19-28/h22-24H,6-21H2,1-5H3.
What are the key properties of 4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine?
4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine has a molecular weight of 434.71 g/mol, XLogP of 3.54, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[2,3-dimethyl-3-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]butan-2-yl]piperidin-4-yl]morpholine is sourced from PubChem (CID 130295884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).