6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline

C19H15N3 — CID 154455775

IUPAC6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline
SMILESC=Cc1ccc(-c2cc3ncncc3c3ccn(C)c23)cc1
InChIInChI=1S/C19H15N3/c1-3-13-4-6-14(7-5-13)16-10-18-17(11-20-12-21-18)15-8-9-22(2)19(15)16/h3-12H,1H2,2H3
InChIKeyCEWFRHDWELUYHX-UHFFFAOYSA-N
MW285.35 g/mol
LogP4.43
Rot. Bonds2

About 6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline

6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline (PubChem CID 154455775) has the molecular formula C19H15N3 and a molecular weight of 285.35 g/mol. Its IUPAC name is 6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline.

Molecular Properties

Compound Name6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline
PubChem CID154455775
Molecular FormulaC19H15N3
Molecular Weight285.35 g/mol
Exact Mass285.13
IUPAC Name6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline
SMILESC=Cc1ccc(-c2cc3ncncc3c3ccn(C)c23)cc1
InChIInChI=1S/C19H15N3/c1-3-13-4-6-14(7-5-13)16-10-18-17(11-20-12-21-18)15-8-9-22(2)19(15)16/h3-12H,1H2,2H3
InChIKeyCEWFRHDWELUYHX-UHFFFAOYSA-N
XLogP4.43
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline?
The IUPAC name of 6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline (CID 154455775) is 6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline.
What is the SMILES notation for 6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline?
The canonical SMILES for 6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline is C=Cc1ccc(-c2cc3ncncc3c3ccn(C)c23)cc1.
What is the InChIKey of 6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline?
The InChIKey is CEWFRHDWELUYHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3/c1-3-13-4-6-14(7-5-13)16-10-18-17(11-20-12-21-18)15-8-9-22(2)19(15)16/h3-12H,1H2,2H3.
What are the key properties of 6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline?
6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline has a molecular weight of 285.35 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-ethenylphenyl)-7-methylpyrrolo[3,2-f]quinazoline is sourced from PubChem (CID 154455775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).