6-hydroxy-4-methoxyquinazoline-2-carbaldehyde

C10H8N2O3 — CID 84777721

IUPAC6-hydroxy-4-methoxyquinazoline-2-carbaldehyde
SMILESCOc1nc(C=O)nc2ccc(O)cc12
InChIInChI=1S/C10H8N2O3/c1-15-10-7-4-6(14)2-3-8(7)11-9(5-13)12-10/h2-5,14H,1H3
InChIKeySGYCHYTWFBYBLY-UHFFFAOYSA-N
MW204.19 g/mol
LogP1.16
Rot. Bonds2

About 6-hydroxy-4-methoxyquinazoline-2-carbaldehyde

6-hydroxy-4-methoxyquinazoline-2-carbaldehyde (PubChem CID 84777721) has the molecular formula C10H8N2O3 and a molecular weight of 204.19 g/mol. Its IUPAC name is 6-hydroxy-4-methoxyquinazoline-2-carbaldehyde.

Molecular Properties

Compound Name6-hydroxy-4-methoxyquinazoline-2-carbaldehyde
PubChem CID84777721
Molecular FormulaC10H8N2O3
Molecular Weight204.19 g/mol
Exact Mass204.05
IUPAC Name6-hydroxy-4-methoxyquinazoline-2-carbaldehyde
SMILESCOc1nc(C=O)nc2ccc(O)cc12
InChIInChI=1S/C10H8N2O3/c1-15-10-7-4-6(14)2-3-8(7)11-9(5-13)12-10/h2-5,14H,1H3
InChIKeySGYCHYTWFBYBLY-UHFFFAOYSA-N
XLogP1.16
TPSA72.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

4-methoxy-7-methylquinazoline-2-carbaldehyde
CID 84776726
8-chloro-4-methoxyquinazoline-2-carbaldehyde
CID 84788775
2,3-dimethoxyquinoline-4-carbaldehyde;hydrazine
CID 174591909
2-(2-formyl-5-hydroxyphenyl)-4-hydroxy-3-methoxybenzaldehyde
CID 141256156
ethane;4-hydroxyphthalaldehyde
CID 90973394
2,4,6-trimethoxyquinoline-3-carbaldehyde
CID 3441994
3-methoxy-4-methyl-2-(trifluoromethyl)quinolin-6-ol
CID 123398426
2-(4-methoxy-6-methylquinazolin-2-yl)acetic acid
CID 84795271
methyl 4-[(2,7-dihydroxyacridin-9-yl)oxyamino]oxy-3,5-dimethylbenzoate
CID 143363540
methyl 3-hydroxyacridine-9-carboxylate
CID 135618678
4-hydroxy-2-[(Z)-2-(4-methoxyanilino)ethenyl]benzaldehyde
CID 89337274
ethyl 5-hydroxy-3-methoxyindazole-1-carboxylate
CID 156851175

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-4-methoxyquinazoline-2-carbaldehyde?
The IUPAC name of 6-hydroxy-4-methoxyquinazoline-2-carbaldehyde (CID 84777721) is 6-hydroxy-4-methoxyquinazoline-2-carbaldehyde.
What is the SMILES notation for 6-hydroxy-4-methoxyquinazoline-2-carbaldehyde?
The canonical SMILES for 6-hydroxy-4-methoxyquinazoline-2-carbaldehyde is COc1nc(C=O)nc2ccc(O)cc12.
What is the InChIKey of 6-hydroxy-4-methoxyquinazoline-2-carbaldehyde?
The InChIKey is SGYCHYTWFBYBLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O3/c1-15-10-7-4-6(14)2-3-8(7)11-9(5-13)12-10/h2-5,14H,1H3.
What are the key properties of 6-hydroxy-4-methoxyquinazoline-2-carbaldehyde?
6-hydroxy-4-methoxyquinazoline-2-carbaldehyde has a molecular weight of 204.19 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-4-methoxyquinazoline-2-carbaldehyde is sourced from PubChem (CID 84777721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).