7-prop-2-enylquinazolin-8-ol

C11H10N2O — CID 119093717

IUPAC7-prop-2-enylquinazolin-8-ol
SMILESC=CCc1ccc2cncnc2c1O
InChIInChI=1S/C11H10N2O/c1-2-3-8-4-5-9-6-12-7-13-10(9)11(8)14/h2,4-7,14H,1,3H2
InChIKeyRSUANXGCNJOXOI-UHFFFAOYSA-N
MW186.21 g/mol
LogP2.06
Rot. Bonds2

About 7-prop-2-enylquinazolin-8-ol

7-prop-2-enylquinazolin-8-ol (PubChem CID 119093717) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 7-prop-2-enylquinazolin-8-ol.

Molecular Properties

Compound Name7-prop-2-enylquinazolin-8-ol
PubChem CID119093717
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name7-prop-2-enylquinazolin-8-ol
SMILESC=CCc1ccc2cncnc2c1O
InChIInChI=1S/C11H10N2O/c1-2-3-8-4-5-9-6-12-7-13-10(9)11(8)14/h2,4-7,14H,1,3H2
InChIKeyRSUANXGCNJOXOI-UHFFFAOYSA-N
XLogP2.06
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

pyrido[4,3-h]quinazoline
CID 118895264
2-methoxy-3-methyl-6-prop-2-enylphenol
CID 130034718
3-amino-2,6-bis(prop-2-enyl)phenol
CID 158258478
2-fluoro-3-methyl-6-prop-2-enylphenol
CID 107657766
pyrido[4,3-d]pyrimidin-8-ol
CID 59256622
5-bromo-4-prop-2-enylpyrimidine
CID 119085370
3-chloro-4-prop-2-enylphenol
CID 70565458
2-(2-hydroxy-3-prop-2-enylanilino)-6-prop-2-enylphenol
CID 70357054
3-hydroxy-2-methyl-4-prop-2-enylbenzoic acid
CID 90408616
N-(quinazolin-8-ylmethylidene)hydroxylamine
CID 174842521
trichloro-(2-prop-2-enylphenyl)silane
CID 68903994
4-(chloromethyl)-2,6-bis(prop-2-enyl)phenol
CID 70573204

Frequently Asked Questions

What is the IUPAC name of 7-prop-2-enylquinazolin-8-ol?
The IUPAC name of 7-prop-2-enylquinazolin-8-ol (CID 119093717) is 7-prop-2-enylquinazolin-8-ol.
What is the SMILES notation for 7-prop-2-enylquinazolin-8-ol?
The canonical SMILES for 7-prop-2-enylquinazolin-8-ol is C=CCc1ccc2cncnc2c1O.
What is the InChIKey of 7-prop-2-enylquinazolin-8-ol?
The InChIKey is RSUANXGCNJOXOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c1-2-3-8-4-5-9-6-12-7-13-10(9)11(8)14/h2,4-7,14H,1,3H2.
What are the key properties of 7-prop-2-enylquinazolin-8-ol?
7-prop-2-enylquinazolin-8-ol has a molecular weight of 186.21 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-prop-2-enylquinazolin-8-ol is sourced from PubChem (CID 119093717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).