1-methylphthalazin-6-ol

C9H8N2O — CID 175916271

IUPAC1-methylphthalazin-6-ol
SMILESCc1nncc2cc(O)ccc12
InChIInChI=1S/C9H8N2O/c1-6-9-3-2-8(12)4-7(9)5-10-11-6/h2-5,12H,1H3
InChIKeyGTSPYRBJYPPFFV-UHFFFAOYSA-N
MW160.18 g/mol
LogP1.64
Rot. Bonds

About 1-methylphthalazin-6-ol

1-methylphthalazin-6-ol (PubChem CID 175916271) has the molecular formula C9H8N2O and a molecular weight of 160.18 g/mol. Its IUPAC name is 1-methylphthalazin-6-ol.

Molecular Properties

Compound Name1-methylphthalazin-6-ol
PubChem CID175916271
Molecular FormulaC9H8N2O
Molecular Weight160.18 g/mol
Exact Mass160.06
IUPAC Name1-methylphthalazin-6-ol
SMILESCc1nncc2cc(O)ccc12
InChIInChI=1S/C9H8N2O/c1-6-9-3-2-8(12)4-7(9)5-10-11-6/h2-5,12H,1H3
InChIKeyGTSPYRBJYPPFFV-UHFFFAOYSA-N
XLogP1.64
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.18
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1-methylphthalazin-6-yl)morpholine
CID 175916256
4-(5-methoxy-3-methylpyridazin-4-yl)-3-methylphenol
CID 137057864
3,4-bis(4-hydroxyphenyl)isoquinolin-7-ol
CID 136832516
triphenylene-2,6,10-triol
CID 19043276
3,8-dimethylpyridazino[3,4-d]pyridazine
CID 166898197
2-methylquinolin-6-ol
CID 594395
4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine
CID 175916253
CID 159499865
CID 159499865
7-methylnaphthalen-2-ol
CID 67841093
9,12-dimethylbenzo[c]phenanthren-3-ol
CID 15488090
5-methoxy-7-methylnaphthalen-2-ol
CID 10655221
3-(4-hydroxy-2-methylanilino)-4H-1,2,4-triazin-5-one
CID 135651963

Frequently Asked Questions

What is the IUPAC name of 1-methylphthalazin-6-ol?
The IUPAC name of 1-methylphthalazin-6-ol (CID 175916271) is 1-methylphthalazin-6-ol.
What is the SMILES notation for 1-methylphthalazin-6-ol?
The canonical SMILES for 1-methylphthalazin-6-ol is Cc1nncc2cc(O)ccc12.
What is the InChIKey of 1-methylphthalazin-6-ol?
The InChIKey is GTSPYRBJYPPFFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O/c1-6-9-3-2-8(12)4-7(9)5-10-11-6/h2-5,12H,1H3.
What are the key properties of 1-methylphthalazin-6-ol?
1-methylphthalazin-6-ol has a molecular weight of 160.18 g/mol, XLogP of 1.64, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylphthalazin-6-ol is sourced from PubChem (CID 175916271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).