9-methyl-9-azatricyclo[4.2.1.12,5]decane

C10H17N — CID 57288268

IUPAC9-methyl-9-azatricyclo[4.2.1.12,5]decane
SMILESCN1C2CCC1C1CCC2C1
InChIInChI=1S/C10H17N/c1-11-9-4-5-10(11)8-3-2-7(9)6-8/h7-10H,2-6H2,1H3
InChIKeyGDTOZPXWDBQZIU-UHFFFAOYSA-N
MW151.25 g/mol
LogP1.88
Rot. Bonds

About 9-methyl-9-azatricyclo[4.2.1.12,5]decane

9-methyl-9-azatricyclo[4.2.1.12,5]decane (PubChem CID 57288268) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 9-methyl-9-azatricyclo[4.2.1.12,5]decane.

Molecular Properties

Compound Name9-methyl-9-azatricyclo[4.2.1.12,5]decane
PubChem CID57288268
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name9-methyl-9-azatricyclo[4.2.1.12,5]decane
SMILESCN1C2CCC1C1CCC2C1
InChIInChI=1S/C10H17N/c1-11-9-4-5-10(11)8-3-2-7(9)6-8/h7-10H,2-6H2,1H3
InChIKeyGDTOZPXWDBQZIU-UHFFFAOYSA-N
XLogP1.88
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-Azabicyclo(3.2.1)octane, N,2-dimethyl-
CID 47256
3-Azabicyclo(3.2.1)octane, 2-ethyl-N-methyl-
CID 46829
3-Azabicyclo(3.2.1)octane, N,2,4-trimethyl-
CID 46831
3-Azabicyclo(3.2.1)octane, 2,2,3,4-tetramethyl-
CID 47255
3,8-Dimethyl-8-azabicyclo[3.2.1]octane
CID 20469991
7-Azatricyclo[5.3.0.04,8]decane
CID 91155902
4-Methyltropan
CID 129638547
6-Methyl-6-azabicyclo[3.2.2]nonane
CID 12702546
2-Ethyl-1-azabicyclo[3.2.1]octane
CID 18765862
8-Methyl-3-propyl-8-azabicyclo[3.2.1]octane
CID 20594126
3,6,8-Trimethyl-8-azabicyclo[3.2.1]octane
CID 20649380
6,8-Dimethyl-8-azabicyclo[3.2.1]octane
CID 20649381

Frequently Asked Questions

What is the IUPAC name of 9-methyl-9-azatricyclo[4.2.1.12,5]decane?
The IUPAC name of 9-methyl-9-azatricyclo[4.2.1.12,5]decane (CID 57288268) is 9-methyl-9-azatricyclo[4.2.1.12,5]decane.
What is the SMILES notation for 9-methyl-9-azatricyclo[4.2.1.12,5]decane?
The canonical SMILES for 9-methyl-9-azatricyclo[4.2.1.12,5]decane is CN1C2CCC1C1CCC2C1.
What is the InChIKey of 9-methyl-9-azatricyclo[4.2.1.12,5]decane?
The InChIKey is GDTOZPXWDBQZIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-11-9-4-5-10(11)8-3-2-7(9)6-8/h7-10H,2-6H2,1H3.
What are the key properties of 9-methyl-9-azatricyclo[4.2.1.12,5]decane?
9-methyl-9-azatricyclo[4.2.1.12,5]decane has a molecular weight of 151.25 g/mol, XLogP of 1.88, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-9-azatricyclo[4.2.1.12,5]decane is sourced from PubChem (CID 57288268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).