2-butyl-4-phenyl-9H-carbazole

C22H21N — CID 71762272

IUPAC2-butyl-4-phenyl-9H-carbazole
SMILESCCCCc1cc(-c2ccccc2)c2c(c1)[nH]c1ccccc12
InChIInChI=1S/C22H21N/c1-2-3-9-16-14-19(17-10-5-4-6-11-17)22-18-12-7-8-13-20(18)23-21(22)15-16/h4-8,10-15,23H,2-3,9H2,1H3
InChIKeyAJAMUKATONTXEQ-UHFFFAOYSA-N
MW299.42 g/mol
LogP6.33
Rot. Bonds4

About 2-butyl-4-phenyl-9H-carbazole

2-butyl-4-phenyl-9H-carbazole (PubChem CID 71762272) has the molecular formula C22H21N and a molecular weight of 299.42 g/mol. Its IUPAC name is 2-butyl-4-phenyl-9H-carbazole.

Molecular Properties

Compound Name2-butyl-4-phenyl-9H-carbazole
PubChem CID71762272
Molecular FormulaC22H21N
Molecular Weight299.42 g/mol
Exact Mass299.17
IUPAC Name2-butyl-4-phenyl-9H-carbazole
SMILESCCCCc1cc(-c2ccccc2)c2c(c1)[nH]c1ccccc12
InChIInChI=1S/C22H21N/c1-2-3-9-16-14-19(17-10-5-4-6-11-17)22-18-12-7-8-13-20(18)23-21(22)15-16/h4-8,10-15,23H,2-3,9H2,1H3
InChIKeyAJAMUKATONTXEQ-UHFFFAOYSA-N
XLogP6.33
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.42
LogP ≤ 56.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

2-dodecyl-9H-carbazole
CID 21248548
ethane;4-phenyl-9H-carbazole
CID 168948755
4-phenyl-9H-carbazole
CID 22990274
2-octylazulene
CID 101406191
2,5-dibutyl-3-phenylphenol
CID 122215941
bis(9H-carbazole);propane
CID 90987002
2-methyl-4-nonyl-6-phenylphenol
CID 174342860
6,20,34-triphenyl-11,25,39-tri(tetradecyl)tridecacyclo[28.12.0.02,15.03,8.04,41.09,14.013,18.016,29.017,22.023,28.027,32.031,36.037,42]dotetraconta-1,3,5,7,9,11,13,15,17(22),18,20,23,25,27(32),28,30,33,35,37(42),38,40-henicosaene
CID 132609479
4-phenyl-3-propyl-9H-carbazole
CID 21444099
7,18-bis(4-butyl-2,6-diphenylphenyl)-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaene-6,8,17,19-tetrone
CID 139089394
2,5-dioctyl-3-phenyl-1H-pyrrole
CID 174734668
N-butyl-1-phenyl-9H-carbazol-3-amine
CID 168786121

Frequently Asked Questions

What is the IUPAC name of 2-butyl-4-phenyl-9H-carbazole?
The IUPAC name of 2-butyl-4-phenyl-9H-carbazole (CID 71762272) is 2-butyl-4-phenyl-9H-carbazole.
What is the SMILES notation for 2-butyl-4-phenyl-9H-carbazole?
The canonical SMILES for 2-butyl-4-phenyl-9H-carbazole is CCCCc1cc(-c2ccccc2)c2c(c1)[nH]c1ccccc12.
What is the InChIKey of 2-butyl-4-phenyl-9H-carbazole?
The InChIKey is AJAMUKATONTXEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N/c1-2-3-9-16-14-19(17-10-5-4-6-11-17)22-18-12-7-8-13-20(18)23-21(22)15-16/h4-8,10-15,23H,2-3,9H2,1H3.
What are the key properties of 2-butyl-4-phenyl-9H-carbazole?
2-butyl-4-phenyl-9H-carbazole has a molecular weight of 299.42 g/mol, XLogP of 6.33, 4 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-4-phenyl-9H-carbazole is sourced from PubChem (CID 71762272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).