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

C10H17N — CID 637990

IUPAC2-methyl-2-azatricyclo[3.3.1.13,7]decane
SMILESCN1C2CC3CC(C2)CC1C3
InChIInChI=1S/C10H17N/c1-11-9-3-7-2-8(5-9)6-10(11)4-7/h7-10H,2-6H2,1H3
InChIKeyJDQFZGRYSUMQTF-UHFFFAOYSA-N
MW151.25 g/mol
LogP1.88
Rot. Bonds

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

2-methyl-2-azatricyclo[3.3.1.13,7]decane (PubChem CID 637990) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 2-methyl-2-azatricyclo[3.3.1.13,7]decane.

Molecular Properties

Compound Name2-methyl-2-azatricyclo[3.3.1.13,7]decane
PubChem CID637990
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name2-methyl-2-azatricyclo[3.3.1.13,7]decane
SMILESCN1C2CC3CC(C2)CC1C3
InChIInChI=1S/C10H17N/c1-11-9-3-7-2-8(5-9)6-10(11)4-7/h7-10H,2-6H2,1H3
InChIKeyJDQFZGRYSUMQTF-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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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-azatricyclo[3.3.1.13,7]decane?
The IUPAC name of 2-methyl-2-azatricyclo[3.3.1.13,7]decane (CID 637990) is 2-methyl-2-azatricyclo[3.3.1.13,7]decane.
What is the SMILES notation for 2-methyl-2-azatricyclo[3.3.1.13,7]decane?
The canonical SMILES for 2-methyl-2-azatricyclo[3.3.1.13,7]decane is CN1C2CC3CC(C2)CC1C3.
What is the InChIKey of 2-methyl-2-azatricyclo[3.3.1.13,7]decane?
The InChIKey is JDQFZGRYSUMQTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-11-9-3-7-2-8(5-9)6-10(11)4-7/h7-10H,2-6H2,1H3.
What are the key properties of 2-methyl-2-azatricyclo[3.3.1.13,7]decane?
2-methyl-2-azatricyclo[3.3.1.13,7]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 2-methyl-2-azatricyclo[3.3.1.13,7]decane is sourced from PubChem (CID 637990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).