1-methyl-2-azatricyclo[3.3.1.13,7]decane

C10H17N — CID 57485169

IUPAC1-methyl-2-azatricyclo[3.3.1.13,7]decane
SMILESCC12CC3CC(CC(C3)N1)C2
InChIInChI=1S/C10H17N/c1-10-5-7-2-8(6-10)4-9(3-7)11-10/h7-9,11H,2-6H2,1H3
InChIKeyCINXLCHKHMLIBB-UHFFFAOYSA-N
MW151.25 g/mol
LogP1.93
Rot. Bonds

About 1-methyl-2-azatricyclo[3.3.1.13,7]decane

1-methyl-2-azatricyclo[3.3.1.13,7]decane (PubChem CID 57485169) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 1-methyl-2-azatricyclo[3.3.1.13,7]decane.

Molecular Properties

Compound Name1-methyl-2-azatricyclo[3.3.1.13,7]decane
PubChem CID57485169
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name1-methyl-2-azatricyclo[3.3.1.13,7]decane
SMILESCC12CC3CC(CC(C3)N1)C2
InChIInChI=1S/C10H17N/c1-10-5-7-2-8(6-10)4-9(3-7)11-10/h7-9,11H,2-6H2,1H3
InChIKeyCINXLCHKHMLIBB-UHFFFAOYSA-N
XLogP1.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-methyl-2-azatricyclo[3.3.1.13,7]decane 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 1-methyl-2-azatricyclo[3.3.1.13,7]decane?
The IUPAC name of 1-methyl-2-azatricyclo[3.3.1.13,7]decane (CID 57485169) is 1-methyl-2-azatricyclo[3.3.1.13,7]decane.
What is the SMILES notation for 1-methyl-2-azatricyclo[3.3.1.13,7]decane?
The canonical SMILES for 1-methyl-2-azatricyclo[3.3.1.13,7]decane is CC12CC3CC(CC(C3)N1)C2.
What is the InChIKey of 1-methyl-2-azatricyclo[3.3.1.13,7]decane?
The InChIKey is CINXLCHKHMLIBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-10-5-7-2-8(6-10)4-9(3-7)11-10/h7-9,11H,2-6H2,1H3.
What are the key properties of 1-methyl-2-azatricyclo[3.3.1.13,7]decane?
1-methyl-2-azatricyclo[3.3.1.13,7]decane has a molecular weight of 151.25 g/mol, XLogP of 1.93, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-azatricyclo[3.3.1.13,7]decane is sourced from PubChem (CID 57485169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).