1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole

C26H19FN2 — CID 175508269

IUPAC1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole
SMILESCC(F)(c1cccc2c1[nH]c1ccccc12)c1cccc2c1[nH]c1ccccc12
InChIInChI=1S/C26H19FN2/c1-26(27,20-12-6-10-18-16-8-2-4-14-22(16)28-24(18)20)21-13-7-11-19-17-9-3-5-15-23(17)29-25(19)21/h2-15,28-29H,1H3
InChIKeyKFNFIKKNXJUHME-UHFFFAOYSA-N
MW378.45 g/mol
LogP7.19
Rot. Bonds2

About 1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole

1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole (PubChem CID 175508269) has the molecular formula C26H19FN2 and a molecular weight of 378.45 g/mol. Its IUPAC name is 1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole.

Molecular Properties

Compound Name1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole
PubChem CID175508269
Molecular FormulaC26H19FN2
Molecular Weight378.45 g/mol
Exact Mass378.15
IUPAC Name1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole
SMILESCC(F)(c1cccc2c1[nH]c1ccccc12)c1cccc2c1[nH]c1ccccc12
InChIInChI=1S/C26H19FN2/c1-26(27,20-12-6-10-18-16-8-2-4-14-22(16)28-24(18)20)21-13-7-11-19-17-9-3-5-15-23(17)29-25(19)21/h2-15,28-29H,1H3
InChIKeyKFNFIKKNXJUHME-UHFFFAOYSA-N
XLogP7.19
TPSA31.58 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.45
LogP ≤ 57.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

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Related Compounds

2-(9H-carbazol-1-yl)-2,2-difluoroacetic acid
CID 175399691
2-methyl-1-(trifluoromethyl)-9H-carbazole
CID 173176935
4-[1-(4-amino-2-methylphenyl)-1-(9H-carbazol-1-yl)ethyl]-3-methylaniline
CID 146643502
1-[2-(9H-carbazol-1-yl)phenyl]-9H-carbazole
CID 66618059
4-bromo-3-(9H-carbazol-1-yl)-1-N,1-N,3-N,3-N-tetramethylbutane-1,3-diamine
CID 57081420
9H-carbazol-1-ylboronic acid
CID 53421584
1-[butoxy(diphenyl)methyl]-9H-carbazole
CID 154189917
9H-carbazole;ethane
CID 91098062
bis(9H-carbazole);ethane
CID 145072085
9H-carbazole
CID 66668984
1-[4-[4-[4-[4-(9H-carbazol-1-yl)phenyl]phenyl]phenyl]phenyl]-9H-carbazole
CID 175958773
12-tert-butyl-11H-indolo[2,3-a]carbazole
CID 172511802

Frequently Asked Questions

What is the IUPAC name of 1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole?
The IUPAC name of 1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole (CID 175508269) is 1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole.
What is the SMILES notation for 1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole?
The canonical SMILES for 1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole is CC(F)(c1cccc2c1[nH]c1ccccc12)c1cccc2c1[nH]c1ccccc12.
What is the InChIKey of 1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole?
The InChIKey is KFNFIKKNXJUHME-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19FN2/c1-26(27,20-12-6-10-18-16-8-2-4-14-22(16)28-24(18)20)21-13-7-11-19-17-9-3-5-15-23(17)29-25(19)21/h2-15,28-29H,1H3.
What are the key properties of 1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole?
1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole has a molecular weight of 378.45 g/mol, XLogP of 7.19, 2 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(9H-carbazol-1-yl)-1-fluoroethyl]-9H-carbazole is sourced from PubChem (CID 175508269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).