6-methyl-3,4-dihydrocinnoline

C9H10N2 — CID 58369743

IUPAC6-methyl-3,4-dihydrocinnoline
SMILESCc1ccc2c(c1)CCN=N2
InChIInChI=1S/C9H10N2/c1-7-2-3-9-8(6-7)4-5-10-11-9/h2-3,6H,4-5H2,1H3
InChIKeyCPPPPZGDYAPDAX-UHFFFAOYSA-N
MW146.19 g/mol
LogP2.63
Rot. Bonds

About 6-methyl-3,4-dihydrocinnoline

6-methyl-3,4-dihydrocinnoline (PubChem CID 58369743) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 6-methyl-3,4-dihydrocinnoline.

Molecular Properties

Compound Name6-methyl-3,4-dihydrocinnoline
PubChem CID58369743
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name6-methyl-3,4-dihydrocinnoline
SMILESCc1ccc2c(c1)CCN=N2
InChIInChI=1S/C9H10N2/c1-7-2-3-9-8(6-7)4-5-10-11-9/h2-3,6H,4-5H2,1H3
InChIKeyCPPPPZGDYAPDAX-UHFFFAOYSA-N
XLogP2.63
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3,4-dihydrocinnoline?
The IUPAC name of 6-methyl-3,4-dihydrocinnoline (CID 58369743) is 6-methyl-3,4-dihydrocinnoline.
What is the SMILES notation for 6-methyl-3,4-dihydrocinnoline?
The canonical SMILES for 6-methyl-3,4-dihydrocinnoline is Cc1ccc2c(c1)CCN=N2.
What is the InChIKey of 6-methyl-3,4-dihydrocinnoline?
The InChIKey is CPPPPZGDYAPDAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2/c1-7-2-3-9-8(6-7)4-5-10-11-9/h2-3,6H,4-5H2,1H3.
What are the key properties of 6-methyl-3,4-dihydrocinnoline?
6-methyl-3,4-dihydrocinnoline has a molecular weight of 146.19 g/mol, XLogP of 2.63, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3,4-dihydrocinnoline is sourced from PubChem (CID 58369743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).