5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol

C14H26N2O — CID 660640

IUPAC5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol
SMILESCCCC12CN3CN(C1)CC(CCC)(C3)C2O
InChIInChI=1S/C14H26N2O/c1-3-5-13-7-15-9-14(6-4-2,12(13)17)10-16(8-13)11-15/h12,17H,3-11H2,1-2H3
InChIKeyJSBGBLBHUQLXJJ-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.52
Rot. Bonds4

About 5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol

5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol (PubChem CID 660640) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol.

Molecular Properties

Compound Name5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol
PubChem CID660640
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol
SMILESCCCC12CN3CN(C1)CC(CCC)(C3)C2O
InChIInChI=1S/C14H26N2O/c1-3-5-13-7-15-9-14(6-4-2,12(13)17)10-16(8-13)11-15/h12,17H,3-11H2,1-2H3
InChIKeyJSBGBLBHUQLXJJ-UHFFFAOYSA-N
XLogP1.52
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol 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 5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol?
The IUPAC name of 5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol (CID 660640) is 5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol.
What is the SMILES notation for 5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol?
The canonical SMILES for 5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol is CCCC12CN3CN(C1)CC(CCC)(C3)C2O.
What is the InChIKey of 5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol?
The InChIKey is JSBGBLBHUQLXJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-3-5-13-7-15-9-14(6-4-2,12(13)17)10-16(8-13)11-15/h12,17H,3-11H2,1-2H3.
What are the key properties of 5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol?
5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol has a molecular weight of 238.37 g/mol, XLogP of 1.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol is sourced from PubChem (CID 660640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).