1,4-dihydroquinazolin-4-ol

C8H8N2O — CID 16640701

IUPAC1,4-dihydroquinazolin-4-ol
SMILESOC1N=CNc2ccccc21
InChIInChI=1S/C8H8N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5,8,11H,(H,9,10)
InChIKeyRFXUVQZRJWPTLS-UHFFFAOYSA-N
MW148.16 g/mol
LogP1.13
Rot. Bonds

About 1,4-dihydroquinazolin-4-ol

1,4-dihydroquinazolin-4-ol (PubChem CID 16640701) has the molecular formula C8H8N2O and a molecular weight of 148.16 g/mol. Its IUPAC name is 1,4-dihydroquinazolin-4-ol.

Molecular Properties

Compound Name1,4-dihydroquinazolin-4-ol
PubChem CID16640701
Molecular FormulaC8H8N2O
Molecular Weight148.16 g/mol
Exact Mass148.06
IUPAC Name1,4-dihydroquinazolin-4-ol
SMILESOC1N=CNc2ccccc21
InChIInChI=1S/C8H8N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5,8,11H,(H,9,10)
InChIKeyRFXUVQZRJWPTLS-UHFFFAOYSA-N
XLogP1.13
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1,4-dihydroquinazolin-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,4-dihydroquinazolin-4-ol?
The IUPAC name of 1,4-dihydroquinazolin-4-ol (CID 16640701) is 1,4-dihydroquinazolin-4-ol.
What is the SMILES notation for 1,4-dihydroquinazolin-4-ol?
The canonical SMILES for 1,4-dihydroquinazolin-4-ol is OC1N=CNc2ccccc21.
What is the InChIKey of 1,4-dihydroquinazolin-4-ol?
The InChIKey is RFXUVQZRJWPTLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5,8,11H,(H,9,10).
What are the key properties of 1,4-dihydroquinazolin-4-ol?
1,4-dihydroquinazolin-4-ol has a molecular weight of 148.16 g/mol, XLogP of 1.13, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dihydroquinazolin-4-ol is sourced from PubChem (CID 16640701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).