pyrido[4,3-d]pyrimidin-8-ol

C7H5N3O — CID 59256622

IUPACpyrido[4,3-d]pyrimidin-8-ol
SMILESOc1cncc2cncnc12
InChIInChI=1S/C7H5N3O/c11-6-3-8-1-5-2-9-4-10-7(5)6/h1-4,11H
InChIKeyOZEKJQSONBSKRW-UHFFFAOYSA-N
MW147.14 g/mol
LogP0.73
Rot. Bonds

About pyrido[4,3-d]pyrimidin-8-ol

pyrido[4,3-d]pyrimidin-8-ol (PubChem CID 59256622) has the molecular formula C7H5N3O and a molecular weight of 147.14 g/mol. Its IUPAC name is pyrido[4,3-d]pyrimidin-8-ol.

Molecular Properties

Compound Namepyrido[4,3-d]pyrimidin-8-ol
PubChem CID59256622
Molecular FormulaC7H5N3O
Molecular Weight147.14 g/mol
Exact Mass147.04
IUPAC Namepyrido[4,3-d]pyrimidin-8-ol
SMILESOc1cncc2cncnc12
InChIInChI=1S/C7H5N3O/c11-6-3-8-1-5-2-9-4-10-7(5)6/h1-4,11H
InChIKeyOZEKJQSONBSKRW-UHFFFAOYSA-N
XLogP0.73
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.14
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of pyrido[4,3-d]pyrimidin-8-ol?
The IUPAC name of pyrido[4,3-d]pyrimidin-8-ol (CID 59256622) is pyrido[4,3-d]pyrimidin-8-ol.
What is the SMILES notation for pyrido[4,3-d]pyrimidin-8-ol?
The canonical SMILES for pyrido[4,3-d]pyrimidin-8-ol is Oc1cncc2cncnc12.
What is the InChIKey of pyrido[4,3-d]pyrimidin-8-ol?
The InChIKey is OZEKJQSONBSKRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5N3O/c11-6-3-8-1-5-2-9-4-10-7(5)6/h1-4,11H.
What are the key properties of pyrido[4,3-d]pyrimidin-8-ol?
pyrido[4,3-d]pyrimidin-8-ol has a molecular weight of 147.14 g/mol, XLogP of 0.73, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for pyrido[4,3-d]pyrimidin-8-ol is sourced from PubChem (CID 59256622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).