11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone

C23H14FNO — CID 175080040

IUPAC11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone
SMILESO=C(c1ccc(F)cc1)c1cccc2ccc3c4ccccc4[nH]c3c12
InChIInChI=1S/C23H14FNO/c24-16-11-8-15(9-12-16)23(26)19-6-3-4-14-10-13-18-17-5-1-2-7-20(17)25-22(18)21(14)19/h1-13,25H
InChIKeyFAYKRLJKKHPMBW-UHFFFAOYSA-N
MW339.37 g/mol
LogP5.84
Rot. Bonds2

About 11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone

11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone (PubChem CID 175080040) has the molecular formula C23H14FNO and a molecular weight of 339.37 g/mol. Its IUPAC name is 11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone.

Molecular Properties

Compound Name11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone
PubChem CID175080040
Molecular FormulaC23H14FNO
Molecular Weight339.37 g/mol
Exact Mass339.11
IUPAC Name11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone
SMILESO=C(c1ccc(F)cc1)c1cccc2ccc3c4ccccc4[nH]c3c12
InChIInChI=1S/C23H14FNO/c24-16-11-8-15(9-12-16)23(26)19-6-3-4-14-10-13-18-17-5-1-2-7-20(17)25-22(18)21(14)19/h1-13,25H
InChIKeyFAYKRLJKKHPMBW-UHFFFAOYSA-N
XLogP5.84
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.37
LogP ≤ 55.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone?
The IUPAC name of 11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone (CID 175080040) is 11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone.
What is the SMILES notation for 11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone?
The canonical SMILES for 11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone is O=C(c1ccc(F)cc1)c1cccc2ccc3c4ccccc4[nH]c3c12.
What is the InChIKey of 11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone?
The InChIKey is FAYKRLJKKHPMBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H14FNO/c24-16-11-8-15(9-12-16)23(26)19-6-3-4-14-10-13-18-17-5-1-2-7-20(17)25-22(18)21(14)19/h1-13,25H.
What are the key properties of 11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone?
11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone has a molecular weight of 339.37 g/mol, XLogP of 5.84, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 11H-benzo[a]carbazol-1-yl-(4-fluorophenyl)methanone is sourced from PubChem (CID 175080040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).