4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole

C20H14F3NO — CID 175538568

IUPAC4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole
SMILESFC(F)(F)c1ccc(COc2cccc3[nH]c4ccccc4c23)cc1
InChIInChI=1S/C20H14F3NO/c21-20(22,23)14-10-8-13(9-11-14)12-25-18-7-3-6-17-19(18)15-4-1-2-5-16(15)24-17/h1-11,24H,12H2
InChIKeyUTMRJLVACHHLIX-UHFFFAOYSA-N
MW341.33 g/mol
LogP5.92
Rot. Bonds3

About 4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole

4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole (PubChem CID 175538568) has the molecular formula C20H14F3NO and a molecular weight of 341.33 g/mol. Its IUPAC name is 4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole.

Molecular Properties

Compound Name4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole
PubChem CID175538568
Molecular FormulaC20H14F3NO
Molecular Weight341.33 g/mol
Exact Mass341.10
IUPAC Name4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole
SMILESFC(F)(F)c1ccc(COc2cccc3[nH]c4ccccc4c23)cc1
InChIInChI=1S/C20H14F3NO/c21-20(22,23)14-10-8-13(9-11-14)12-25-18-7-3-6-17-19(18)15-4-1-2-5-16(15)24-17/h1-11,24H,12H2
InChIKeyUTMRJLVACHHLIX-UHFFFAOYSA-N
XLogP5.92
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.33
LogP ≤ 55.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(trifluoromethyl)-2-[[4-(trifluoromethyl)phenyl]methoxy]benzene
CID 174057400
4-(2,2-dimethylpropoxy)-9H-carbazole
CID 59827319
1-(9H-carbazol-4-yloxy)-2-methylpropan-2-ol
CID 101255644
1,3-bis(9H-carbazol-4-yloxy)propan-2-ol
CID 71314054
2-[[4-(trifluoromethyl)phenyl]methoxy]benzaldehyde
CID 60681232
(2R)-1-(9H-carbazol-4-yloxy)butan-2-ol
CID 58878130
(2S)-1-(9H-carbazol-4-yloxy)-2-fluoro-3-(propan-2-ylamino)propan-2-ol
CID 54531034
1-nitro-2-[[4-(trifluoromethyl)phenyl]methoxy]benzene
CID 18551352
2-fluoro-6-[[4-(trifluoromethyl)phenyl]methoxy]benzonitrile
CID 18525684
[2-bromo-6-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]methanol
CID 19261601
2-methoxy-3-[[4-(trifluoromethyl)phenyl]methoxy]naphthalene
CID 177493638
2-[4-methoxy-3-[[4-(trifluoromethyl)phenyl]methoxymethyl]-1H-indol-2-yl]butanoate
CID 150411797

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole?
The IUPAC name of 4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole (CID 175538568) is 4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole.
What is the SMILES notation for 4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole?
The canonical SMILES for 4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole is FC(F)(F)c1ccc(COc2cccc3[nH]c4ccccc4c23)cc1.
What is the InChIKey of 4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole?
The InChIKey is UTMRJLVACHHLIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14F3NO/c21-20(22,23)14-10-8-13(9-11-14)12-25-18-7-3-6-17-19(18)15-4-1-2-5-16(15)24-17/h1-11,24H,12H2.
What are the key properties of 4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole?
4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole has a molecular weight of 341.33 g/mol, XLogP of 5.92, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(trifluoromethyl)phenyl]methoxy]-9H-carbazole is sourced from PubChem (CID 175538568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).