2,3-dihydrophthalazin-5-ol

C8H8N2O — CID 18000385

IUPAC2,3-dihydrophthalazin-5-ol
SMILESOc1cccc2c1=CNNC=2
InChIInChI=1S/C8H8N2O/c11-8-3-1-2-6-4-9-10-5-7(6)8/h1-5,9-11H
InChIKeyVWKWTBDNYUHGGD-UHFFFAOYSA-N
MW148.16 g/mol
LogP-1.02
Rot. Bonds

About 2,3-dihydrophthalazin-5-ol

2,3-dihydrophthalazin-5-ol (PubChem CID 18000385) has the molecular formula C8H8N2O and a molecular weight of 148.16 g/mol. Its IUPAC name is 2,3-dihydrophthalazin-5-ol.

Molecular Properties

Compound Name2,3-dihydrophthalazin-5-ol
PubChem CID18000385
Molecular FormulaC8H8N2O
Molecular Weight148.16 g/mol
Exact Mass148.06
IUPAC Name2,3-dihydrophthalazin-5-ol
SMILESOc1cccc2c1=CNNC=2
InChIInChI=1S/C8H8N2O/c11-8-3-1-2-6-4-9-10-5-7(6)8/h1-5,9-11H
InChIKeyVWKWTBDNYUHGGD-UHFFFAOYSA-N
XLogP-1.02
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 5-1.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrophthalazin-5-ol?
The IUPAC name of 2,3-dihydrophthalazin-5-ol (CID 18000385) is 2,3-dihydrophthalazin-5-ol.
What is the SMILES notation for 2,3-dihydrophthalazin-5-ol?
The canonical SMILES for 2,3-dihydrophthalazin-5-ol is Oc1cccc2c1=CNNC=2.
What is the InChIKey of 2,3-dihydrophthalazin-5-ol?
The InChIKey is VWKWTBDNYUHGGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O/c11-8-3-1-2-6-4-9-10-5-7(6)8/h1-5,9-11H.
What are the key properties of 2,3-dihydrophthalazin-5-ol?
2,3-dihydrophthalazin-5-ol has a molecular weight of 148.16 g/mol, XLogP of -1.02, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrophthalazin-5-ol is sourced from PubChem (CID 18000385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).