1,5-dimethyl-6,7-dihydrophthalazine

C10H12N2 — CID 89495223

IUPAC1,5-dimethyl-6,7-dihydrophthalazine
SMILESCC1=c2cnnc(C)c2=CCC1
InChIInChI=1S/C10H12N2/c1-7-4-3-5-9-8(2)12-11-6-10(7)9/h5-6H,3-4H2,1-2H3
InChIKeySIWPBRZELPXFBB-UHFFFAOYSA-N
MW160.22 g/mol
LogP0.53
Rot. Bonds

About 1,5-dimethyl-6,7-dihydrophthalazine

1,5-dimethyl-6,7-dihydrophthalazine (PubChem CID 89495223) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 1,5-dimethyl-6,7-dihydrophthalazine.

Molecular Properties

Compound Name1,5-dimethyl-6,7-dihydrophthalazine
PubChem CID89495223
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name1,5-dimethyl-6,7-dihydrophthalazine
SMILESCC1=c2cnnc(C)c2=CCC1
InChIInChI=1S/C10H12N2/c1-7-4-3-5-9-8(2)12-11-6-10(7)9/h5-6H,3-4H2,1-2H3
InChIKeySIWPBRZELPXFBB-UHFFFAOYSA-N
XLogP0.53
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 50.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1,5-dimethyl-6,7-dihydrophthalazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-6,7-dihydrophthalazine?
The IUPAC name of 1,5-dimethyl-6,7-dihydrophthalazine (CID 89495223) is 1,5-dimethyl-6,7-dihydrophthalazine.
What is the SMILES notation for 1,5-dimethyl-6,7-dihydrophthalazine?
The canonical SMILES for 1,5-dimethyl-6,7-dihydrophthalazine is CC1=c2cnnc(C)c2=CCC1.
What is the InChIKey of 1,5-dimethyl-6,7-dihydrophthalazine?
The InChIKey is SIWPBRZELPXFBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-7-4-3-5-9-8(2)12-11-6-10(7)9/h5-6H,3-4H2,1-2H3.
What are the key properties of 1,5-dimethyl-6,7-dihydrophthalazine?
1,5-dimethyl-6,7-dihydrophthalazine has a molecular weight of 160.22 g/mol, XLogP of 0.53, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-6,7-dihydrophthalazine is sourced from PubChem (CID 89495223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).