3,6-dimethyl-1,8-diphenyl-9H-carbazole

C26H21N — CID 71440735

IUPAC3,6-dimethyl-1,8-diphenyl-9H-carbazole
SMILESCc1cc(-c2ccccc2)c2[nH]c3c(-c4ccccc4)cc(C)cc3c2c1
InChIInChI=1S/C26H21N/c1-17-13-21(19-9-5-3-6-10-19)25-23(15-17)24-16-18(2)14-22(26(24)27-25)20-11-7-4-8-12-20/h3-16,27H,1-2H3
InChIKeyVYEYRKZHARMKRX-UHFFFAOYSA-N
MW347.46 g/mol
LogP7.27
Rot. Bonds2

About 3,6-dimethyl-1,8-diphenyl-9H-carbazole

3,6-dimethyl-1,8-diphenyl-9H-carbazole (PubChem CID 71440735) has the molecular formula C26H21N and a molecular weight of 347.46 g/mol. Its IUPAC name is 3,6-dimethyl-1,8-diphenyl-9H-carbazole.

Molecular Properties

Compound Name3,6-dimethyl-1,8-diphenyl-9H-carbazole
PubChem CID71440735
Molecular FormulaC26H21N
Molecular Weight347.46 g/mol
Exact Mass347.17
IUPAC Name3,6-dimethyl-1,8-diphenyl-9H-carbazole
SMILESCc1cc(-c2ccccc2)c2[nH]c3c(-c4ccccc4)cc(C)cc3c2c1
InChIInChI=1S/C26H21N/c1-17-13-21(19-9-5-3-6-10-19)25-23(15-17)24-16-18(2)14-22(26(24)27-25)20-11-7-4-8-12-20/h3-16,27H,1-2H3
InChIKeyVYEYRKZHARMKRX-UHFFFAOYSA-N
XLogP7.27
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.46
LogP ≤ 57.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole
CID 140902282
(4-methyl-2,6-diphenylphenyl)stibane
CID 173432730
1-phenyl-3-(1-phenyl-9H-carbazol-3-yl)-9H-carbazole
CID 175910913
3,6-dimethyl-1-phenylnaphthalene
CID 123256332
1,3,6-triphenyl-9H-carbazole
CID 118052457
1,2,5-trimethyl-3-phenylbenzene;hydrate
CID 130423762
5-methyl-1,3-diphenyl-2-propan-2-ylbenzene
CID 140664566
[4-(3,6-dimethyl-9H-carbazol-1-yl)phenyl]boronic acid
CID 153327063
1-[3-[4-[4-(3-methylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-8-(4-phenylphenyl)-9H-carbazole
CID 126496171
N-[4-(3,6-dimethyl-9H-carbazol-1-yl)phenyl]-2,4,6-trimethylaniline
CID 174882577
4-methyl-1-phenyl-2-(2-phenylphenyl)benzene
CID 59171641
1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene
CID 123422549

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-1,8-diphenyl-9H-carbazole?
The IUPAC name of 3,6-dimethyl-1,8-diphenyl-9H-carbazole (CID 71440735) is 3,6-dimethyl-1,8-diphenyl-9H-carbazole.
What is the SMILES notation for 3,6-dimethyl-1,8-diphenyl-9H-carbazole?
The canonical SMILES for 3,6-dimethyl-1,8-diphenyl-9H-carbazole is Cc1cc(-c2ccccc2)c2[nH]c3c(-c4ccccc4)cc(C)cc3c2c1.
What is the InChIKey of 3,6-dimethyl-1,8-diphenyl-9H-carbazole?
The InChIKey is VYEYRKZHARMKRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21N/c1-17-13-21(19-9-5-3-6-10-19)25-23(15-17)24-16-18(2)14-22(26(24)27-25)20-11-7-4-8-12-20/h3-16,27H,1-2H3.
What are the key properties of 3,6-dimethyl-1,8-diphenyl-9H-carbazole?
3,6-dimethyl-1,8-diphenyl-9H-carbazole has a molecular weight of 347.46 g/mol, XLogP of 7.27, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-1,8-diphenyl-9H-carbazole is sourced from PubChem (CID 71440735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).