2-benzyl-9-(4-fluorophenyl)carbazole

C25H18FN — CID 161167976

IUPAC2-benzyl-9-(4-fluorophenyl)carbazole
SMILESFc1ccc(-n2c3ccccc3c3ccc(Cc4ccccc4)cc32)cc1
InChIInChI=1S/C25H18FN/c26-20-11-13-21(14-12-20)27-24-9-5-4-8-22(24)23-15-10-19(17-25(23)27)16-18-6-2-1-3-7-18/h1-15,17H,16H2
InChIKeyBEEVOMKPKURDEU-UHFFFAOYSA-N
MW351.42 g/mol
LogP6.51
Rot. Bonds3

About 2-benzyl-9-(4-fluorophenyl)carbazole

2-benzyl-9-(4-fluorophenyl)carbazole (PubChem CID 161167976) has the molecular formula C25H18FN and a molecular weight of 351.42 g/mol. Its IUPAC name is 2-benzyl-9-(4-fluorophenyl)carbazole.

Molecular Properties

Compound Name2-benzyl-9-(4-fluorophenyl)carbazole
PubChem CID161167976
Molecular FormulaC25H18FN
Molecular Weight351.42 g/mol
Exact Mass351.14
IUPAC Name2-benzyl-9-(4-fluorophenyl)carbazole
SMILESFc1ccc(-n2c3ccccc3c3ccc(Cc4ccccc4)cc32)cc1
InChIInChI=1S/C25H18FN/c26-20-11-13-21(14-12-20)27-24-9-5-4-8-22(24)23-15-10-19(17-25(23)27)16-18-6-2-1-3-7-18/h1-15,17H,16H2
InChIKeyBEEVOMKPKURDEU-UHFFFAOYSA-N
XLogP6.51
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.42
LogP ≤ 56.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-benzyl-9-(4-fluorophenyl)carbazole
CID 118374782
9-[4-[(3-methylphenyl)methyl]phenyl]carbazole
CID 143035757
9-(4-fluorophenyl)-2-methylcarbazole
CID 148964710
9-(4-phenylphenyl)-3-[4-[4-[(4-phenylphenyl)methyl]phenyl]phenyl]carbazole
CID 158819686
9-(4-chlorophenyl)-2-fluorocarbazole
CID 169073574
2-carbazol-9-yl-9-phenylcarbazole
CID 118335086
(4-fluorophenyl)-diphenyl-(9-phenylcarbazol-2-yl)silane
CID 160801303
9-(18-benzyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15(20),16,18-nonaen-5-yl)carbazole
CID 59147032
9-phenyl-3-[4-[[4-(4-phenylphenyl)phenyl]methyl]phenyl]carbazole
CID 157272513
7-fluoro-N,9-diphenyl-N-(9-phenylcarbazol-2-yl)carbazol-2-amine
CID 138549065
9-[4-[4-[[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]methyl]phenyl]phenyl]carbazole
CID 146506354
3-fluoro-9-[4-[4-(3-fluorocarbazol-9-yl)phenyl]phenyl]carbazole
CID 23534181

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-9-(4-fluorophenyl)carbazole?
The IUPAC name of 2-benzyl-9-(4-fluorophenyl)carbazole (CID 161167976) is 2-benzyl-9-(4-fluorophenyl)carbazole.
What is the SMILES notation for 2-benzyl-9-(4-fluorophenyl)carbazole?
The canonical SMILES for 2-benzyl-9-(4-fluorophenyl)carbazole is Fc1ccc(-n2c3ccccc3c3ccc(Cc4ccccc4)cc32)cc1.
What is the InChIKey of 2-benzyl-9-(4-fluorophenyl)carbazole?
The InChIKey is BEEVOMKPKURDEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18FN/c26-20-11-13-21(14-12-20)27-24-9-5-4-8-22(24)23-15-10-19(17-25(23)27)16-18-6-2-1-3-7-18/h1-15,17H,16H2.
What are the key properties of 2-benzyl-9-(4-fluorophenyl)carbazole?
2-benzyl-9-(4-fluorophenyl)carbazole has a molecular weight of 351.42 g/mol, XLogP of 6.51, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-9-(4-fluorophenyl)carbazole is sourced from PubChem (CID 161167976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).