1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene

C10H16N2 — CID 548920

IUPAC1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene
SMILESCC1=NN=C(C)C12CCCCC2
InChIInChI=1S/C10H16N2/c1-8-10(9(2)12-11-8)6-4-3-5-7-10/h3-7H2,1-2H3
InChIKeyCSCFJBGXTBBUCR-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.79
Rot. Bonds

About 1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene

1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene (PubChem CID 548920) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene.

Molecular Properties

Compound Name1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene
PubChem CID548920
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene
SMILESCC1=NN=C(C)C12CCCCC2
InChIInChI=1S/C10H16N2/c1-8-10(9(2)12-11-8)6-4-3-5-7-10/h3-7H2,1-2H3
InChIKeyCSCFJBGXTBBUCR-UHFFFAOYSA-N
XLogP2.79
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene?
The IUPAC name of 1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene (CID 548920) is 1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene.
What is the SMILES notation for 1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene?
The canonical SMILES for 1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene is CC1=NN=C(C)C12CCCCC2.
What is the InChIKey of 1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene?
The InChIKey is CSCFJBGXTBBUCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-8-10(9(2)12-11-8)6-4-3-5-7-10/h3-7H2,1-2H3.
What are the key properties of 1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene?
1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene has a molecular weight of 164.25 g/mol, XLogP of 2.79, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-2,3-diazaspiro[4.5]deca-1,3-diene is sourced from PubChem (CID 548920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).