6-methyl-1,2,3,4-tetrahydrophthalazine

C9H12N2 — CID 142250671

IUPAC6-methyl-1,2,3,4-tetrahydrophthalazine
SMILESCc1ccc2c(c1)CNNC2
InChIInChI=1S/C9H12N2/c1-7-2-3-8-5-10-11-6-9(8)4-7/h2-4,10-11H,5-6H2,1H3
InChIKeyAYLHYWXUACXLJE-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.10
Rot. Bonds

About 6-methyl-1,2,3,4-tetrahydrophthalazine

6-methyl-1,2,3,4-tetrahydrophthalazine (PubChem CID 142250671) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 6-methyl-1,2,3,4-tetrahydrophthalazine.

Molecular Properties

Compound Name6-methyl-1,2,3,4-tetrahydrophthalazine
PubChem CID142250671
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name6-methyl-1,2,3,4-tetrahydrophthalazine
SMILESCc1ccc2c(c1)CNNC2
InChIInChI=1S/C9H12N2/c1-7-2-3-8-5-10-11-6-9(8)4-7/h2-4,10-11H,5-6H2,1H3
InChIKeyAYLHYWXUACXLJE-UHFFFAOYSA-N
XLogP1.10
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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10,27-dimethylnonacyclo[18.14.0.03,18.04,16.06,14.08,13.021,33.023,31.025,30]tetratriaconta-1,3(18),4,6(14),8(13),9,11,15,19,21,23(31),25(30),26,28,32-pentadecaene
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bis(2,7-dimethyl-9H-fluorene);ethane;methane
CID 159270379
3-fluoro-6-methyl-1,2,3,4-tetrahydroisoquinoline
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2,7-dimethyl-9,10-dihydrophenanthrene
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7-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine
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6-methylspiro[1,2-dihydroisoindole-3,1'-cyclopropane]
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dichlorozirconium;2,7-dimethyl-9H-fluorene
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Frequently Asked Questions

What is the IUPAC name of 6-methyl-1,2,3,4-tetrahydrophthalazine?
The IUPAC name of 6-methyl-1,2,3,4-tetrahydrophthalazine (CID 142250671) is 6-methyl-1,2,3,4-tetrahydrophthalazine.
What is the SMILES notation for 6-methyl-1,2,3,4-tetrahydrophthalazine?
The canonical SMILES for 6-methyl-1,2,3,4-tetrahydrophthalazine is Cc1ccc2c(c1)CNNC2.
What is the InChIKey of 6-methyl-1,2,3,4-tetrahydrophthalazine?
The InChIKey is AYLHYWXUACXLJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-7-2-3-8-5-10-11-6-9(8)4-7/h2-4,10-11H,5-6H2,1H3.
What are the key properties of 6-methyl-1,2,3,4-tetrahydrophthalazine?
6-methyl-1,2,3,4-tetrahydrophthalazine has a molecular weight of 148.21 g/mol, XLogP of 1.10, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1,2,3,4-tetrahydrophthalazine is sourced from PubChem (CID 142250671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).