9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole

C24H19N3 — CID 155538604

IUPAC9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole
SMILESC=C(c1ccc2c(c1)c1ccccc1n2C)c1nc(C)nc2ccccc12
InChIInChI=1S/C24H19N3/c1-15(24-19-9-4-6-10-21(19)25-16(2)26-24)17-12-13-23-20(14-17)18-8-5-7-11-22(18)27(23)3/h4-14H,1H2,2-3H3
InChIKeyAQNMZGAHHAJLOJ-UHFFFAOYSA-N
MW349.44 g/mol
LogP5.64
Rot. Bonds2

About 9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole

9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole (PubChem CID 155538604) has the molecular formula C24H19N3 and a molecular weight of 349.44 g/mol. Its IUPAC name is 9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole.

Molecular Properties

Compound Name9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole
PubChem CID155538604
Molecular FormulaC24H19N3
Molecular Weight349.44 g/mol
Exact Mass349.16
IUPAC Name9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole
SMILESC=C(c1ccc2c(c1)c1ccccc1n2C)c1nc(C)nc2ccccc12
InChIInChI=1S/C24H19N3/c1-15(24-19-9-4-6-10-21(19)25-16(2)26-24)17-12-13-23-20(14-17)18-8-5-7-11-22(18)27(23)3/h4-14H,1H2,2-3H3
InChIKeyAQNMZGAHHAJLOJ-UHFFFAOYSA-N
XLogP5.64
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.44
LogP ≤ 55.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole?
The IUPAC name of 9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole (CID 155538604) is 9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole.
What is the SMILES notation for 9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole?
The canonical SMILES for 9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole is C=C(c1ccc2c(c1)c1ccccc1n2C)c1nc(C)nc2ccccc12.
What is the InChIKey of 9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole?
The InChIKey is AQNMZGAHHAJLOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3/c1-15(24-19-9-4-6-10-21(19)25-16(2)26-24)17-12-13-23-20(14-17)18-8-5-7-11-22(18)27(23)3/h4-14H,1H2,2-3H3.
What are the key properties of 9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole?
9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole has a molecular weight of 349.44 g/mol, XLogP of 5.64, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-3-[1-(2-methylquinazolin-4-yl)ethenyl]carbazole is sourced from PubChem (CID 155538604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).