1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane

C8H15N — CID 163572928

IUPAC1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane
SMILESCC1C(C)C2(C)C1N2C
InChIInChI=1S/C8H15N/c1-5-6(2)8(3)7(5)9(8)4/h5-7H,1-4H3
InChIKeyGAXSONXINXCCLY-UHFFFAOYSA-N
MW125.21 g/mol
LogP1.34
Rot. Bonds

About 1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane

1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane (PubChem CID 163572928) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is 1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane.

Molecular Properties

Compound Name1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane
PubChem CID163572928
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC Name1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane
SMILESCC1C(C)C2(C)C1N2C
InChIInChI=1S/C8H15N/c1-5-6(2)8(3)7(5)9(8)4/h5-7H,1-4H3
InChIKeyGAXSONXINXCCLY-UHFFFAOYSA-N
XLogP1.34
TPSA3.01 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane?
The IUPAC name of 1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane (CID 163572928) is 1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane.
What is the SMILES notation for 1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane?
The canonical SMILES for 1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane is CC1C(C)C2(C)C1N2C.
What is the InChIKey of 1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane?
The InChIKey is GAXSONXINXCCLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-5-6(2)8(3)7(5)9(8)4/h5-7H,1-4H3.
What are the key properties of 1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane?
1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane has a molecular weight of 125.21 g/mol, XLogP of 1.34, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,5-tetramethyl-5-azabicyclo[2.1.0]pentane is sourced from PubChem (CID 163572928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).