2,2-dimethyl-7,8-dihydro-1,5-diazonine

C9H14N2 — CID 123571290

IUPAC2,2-dimethyl-7,8-dihydro-1,5-diazonine
SMILESCC1(C)C=C/N=C\CC/C=N\1
InChIInChI=1S/C9H14N2/c1-9(2)5-8-10-6-3-4-7-11-9/h5-8H,3-4H2,1-2H3/b8-5?,10-6-,11-7-
InChIKeyRIEUTOKZDRNINO-NQTXCHCQSA-N
MW150.22 g/mol
LogP2.21
Rot. Bonds

About 2,2-dimethyl-7,8-dihydro-1,5-diazonine

2,2-dimethyl-7,8-dihydro-1,5-diazonine (PubChem CID 123571290) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 2,2-dimethyl-7,8-dihydro-1,5-diazonine.

Molecular Properties

Compound Name2,2-dimethyl-7,8-dihydro-1,5-diazonine
PubChem CID123571290
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name2,2-dimethyl-7,8-dihydro-1,5-diazonine
SMILESCC1(C)C=C/N=C\CC/C=N\1
InChIInChI=1S/C9H14N2/c1-9(2)5-8-10-6-3-4-7-11-9/h5-8H,3-4H2,1-2H3/b8-5?,10-6-,11-7-
InChIKeyRIEUTOKZDRNINO-NQTXCHCQSA-N
XLogP2.21
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-7,8-dihydro-1,5-diazonine?
The IUPAC name of 2,2-dimethyl-7,8-dihydro-1,5-diazonine (CID 123571290) is 2,2-dimethyl-7,8-dihydro-1,5-diazonine.
What is the SMILES notation for 2,2-dimethyl-7,8-dihydro-1,5-diazonine?
The canonical SMILES for 2,2-dimethyl-7,8-dihydro-1,5-diazonine is CC1(C)C=C/N=C\CC/C=N\1.
What is the InChIKey of 2,2-dimethyl-7,8-dihydro-1,5-diazonine?
The InChIKey is RIEUTOKZDRNINO-NQTXCHCQSA-N. The full InChI is InChI=1S/C9H14N2/c1-9(2)5-8-10-6-3-4-7-11-9/h5-8H,3-4H2,1-2H3/b8-5?,10-6-,11-7-.
What are the key properties of 2,2-dimethyl-7,8-dihydro-1,5-diazonine?
2,2-dimethyl-7,8-dihydro-1,5-diazonine has a molecular weight of 150.22 g/mol, XLogP of 2.21, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-7,8-dihydro-1,5-diazonine is sourced from PubChem (CID 123571290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).