1,5-dimethyl-3-azabicyclo[3.2.0]heptane

C8H15N — CID 23049848

IUPAC1,5-dimethyl-3-azabicyclo[3.2.0]heptane
SMILESCC12CCC1(C)CNC2
InChIInChI=1S/C8H15N/c1-7-3-4-8(7,2)6-9-5-7/h9H,3-6H2,1-2H3
InChIKeyPTUWNRVFZNLHBD-UHFFFAOYSA-N
MW125.22 g/mol
LogP1.40
Rot. Bonds

About 1,5-dimethyl-3-azabicyclo[3.2.0]heptane

1,5-dimethyl-3-azabicyclo[3.2.0]heptane (PubChem CID 23049848) has the molecular formula C8H15N and a molecular weight of 125.22 g/mol. Its IUPAC name is 1,5-dimethyl-3-azabicyclo[3.2.0]heptane.

Molecular Properties

Compound Name1,5-dimethyl-3-azabicyclo[3.2.0]heptane
PubChem CID23049848
Molecular FormulaC8H15N
Molecular Weight125.22 g/mol
Exact Mass125.12
IUPAC Name1,5-dimethyl-3-azabicyclo[3.2.0]heptane
SMILESCC12CCC1(C)CNC2
InChIInChI=1S/C8H15N/c1-7-3-4-8(7,2)6-9-5-7/h9H,3-6H2,1-2H3
InChIKeyPTUWNRVFZNLHBD-UHFFFAOYSA-N
XLogP1.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.22
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-3-azabicyclo[3.2.0]heptane?
The IUPAC name of 1,5-dimethyl-3-azabicyclo[3.2.0]heptane (CID 23049848) is 1,5-dimethyl-3-azabicyclo[3.2.0]heptane.
What is the SMILES notation for 1,5-dimethyl-3-azabicyclo[3.2.0]heptane?
The canonical SMILES for 1,5-dimethyl-3-azabicyclo[3.2.0]heptane is CC12CCC1(C)CNC2.
What is the InChIKey of 1,5-dimethyl-3-azabicyclo[3.2.0]heptane?
The InChIKey is PTUWNRVFZNLHBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-7-3-4-8(7,2)6-9-5-7/h9H,3-6H2,1-2H3.
What are the key properties of 1,5-dimethyl-3-azabicyclo[3.2.0]heptane?
1,5-dimethyl-3-azabicyclo[3.2.0]heptane has a molecular weight of 125.22 g/mol, XLogP of 1.40, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-3-azabicyclo[3.2.0]heptane is sourced from PubChem (CID 23049848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).