2-methylimidazo[2,1-a]phthalazin-6-amine

C11H10N4 — CID 2998056

IUPAC2-methylimidazo[2,1-a]phthalazin-6-amine
SMILESCc1cn2nc(N)c3ccccc3c2n1
InChIInChI=1S/C11H10N4/c1-7-6-15-11(13-7)9-5-3-2-4-8(9)10(12)14-15/h2-6H,1H3,(H2,12,14)
InChIKeyQOIJWQJIXFOXCA-UHFFFAOYSA-N
MW198.23 g/mol
LogP1.77
Rot. Bonds

About 2-methylimidazo[2,1-a]phthalazin-6-amine

2-methylimidazo[2,1-a]phthalazin-6-amine (PubChem CID 2998056) has the molecular formula C11H10N4 and a molecular weight of 198.23 g/mol. Its IUPAC name is 2-methylimidazo[2,1-a]phthalazin-6-amine.

Molecular Properties

Compound Name2-methylimidazo[2,1-a]phthalazin-6-amine
PubChem CID2998056
Molecular FormulaC11H10N4
Molecular Weight198.23 g/mol
Exact Mass198.09
IUPAC Name2-methylimidazo[2,1-a]phthalazin-6-amine
SMILESCc1cn2nc(N)c3ccccc3c2n1
InChIInChI=1S/C11H10N4/c1-7-6-15-11(13-7)9-5-3-2-4-8(9)10(12)14-15/h2-6H,1H3,(H2,12,14)
InChIKeyQOIJWQJIXFOXCA-UHFFFAOYSA-N
XLogP1.77
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methylimidazo[2,1-a]phthalazin-6-amine?
The IUPAC name of 2-methylimidazo[2,1-a]phthalazin-6-amine (CID 2998056) is 2-methylimidazo[2,1-a]phthalazin-6-amine.
What is the SMILES notation for 2-methylimidazo[2,1-a]phthalazin-6-amine?
The canonical SMILES for 2-methylimidazo[2,1-a]phthalazin-6-amine is Cc1cn2nc(N)c3ccccc3c2n1.
What is the InChIKey of 2-methylimidazo[2,1-a]phthalazin-6-amine?
The InChIKey is QOIJWQJIXFOXCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4/c1-7-6-15-11(13-7)9-5-3-2-4-8(9)10(12)14-15/h2-6H,1H3,(H2,12,14).
What are the key properties of 2-methylimidazo[2,1-a]phthalazin-6-amine?
2-methylimidazo[2,1-a]phthalazin-6-amine has a molecular weight of 198.23 g/mol, XLogP of 1.77, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylimidazo[2,1-a]phthalazin-6-amine is sourced from PubChem (CID 2998056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).