6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole

C22H21N — CID 142604585

IUPAC6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole
SMILESC/C=C(\C)c1ccc2c(c1)c1c(n2-c2ccccc2)=CCCC=1
InChIInChI=1S/C22H21N/c1-3-16(2)17-13-14-22-20(15-17)19-11-7-8-12-21(19)23(22)18-9-5-4-6-10-18/h3-6,9-15H,7-8H2,1-2H3/b16-3+
InChIKeyQKNKRJHHHGMKBR-HQYXKAPLSA-N
MW299.42 g/mol
LogP4.41
Rot. Bonds2

About 6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole

6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole (PubChem CID 142604585) has the molecular formula C22H21N and a molecular weight of 299.42 g/mol. Its IUPAC name is 6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole.

Molecular Properties

Compound Name6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole
PubChem CID142604585
Molecular FormulaC22H21N
Molecular Weight299.42 g/mol
Exact Mass299.17
IUPAC Name6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole
SMILESC/C=C(\C)c1ccc2c(c1)c1c(n2-c2ccccc2)=CCCC=1
InChIInChI=1S/C22H21N/c1-3-16(2)17-13-14-22-20(15-17)19-11-7-8-12-21(19)23(22)18-9-5-4-6-10-18/h3-6,9-15H,7-8H2,1-2H3/b16-3+
InChIKeyQKNKRJHHHGMKBR-HQYXKAPLSA-N
XLogP4.41
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.42
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-phenyl-3-(9-phenyl-6,7-dihydrocarbazol-3-yl)-6-triphenylen-2-ylcarbazole
CID 162698923
9-phenyl-3-[4-(9-phenyl-6,7-dihydrocarbazol-3-yl)naphthalen-1-yl]carbazole
CID 146359318
2-(9-phenyl-6,7-dihydrocarbazol-3-yl)-9H-carbazole
CID 90051131
7-methyl-6-(2-methylphenyl)-9-phenyl-2,3-dihydrocarbazole
CID 145017239
3-penta-2,4-dien-2-yl-6,9-diphenylcarbazole
CID 123470872
4-[6-[9-[4-(dimethylamino)phenyl]-6-[9-[4-(dimethylamino)phenyl]carbazol-3-yl]carbazol-3-yl]-2,3-dihydrocarbazol-9-yl]-N,N-dimethylaniline
CID 142088052
3-[9-(3-methylphenyl)-6,7-dihydrocarbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 144943040
7,7-dimethyl-5-(9-phenylcarbazol-3-yl)-2,3-dihydroindeno[2,1-b]carbazole
CID 146751614
9-[3-[3-[3,5-bis(3-carbazol-9-ylphenyl)phenyl]-5-[3-(2,3-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole
CID 163995412
N-[4-(9-phenyl-6,7-dihydrocarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
CID 156721201
9-[3-(4-methylphenyl)phenyl]carbazole;3-[(2E)-penta-2,4-dien-2-yl]-6,9-diphenylcarbazole
CID 144875939
3-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-6,9-diphenylcarbazole;9-phenyl-3-(4-phenylphenyl)-6-[4-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 158399670

Frequently Asked Questions

What is the IUPAC name of 6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole?
The IUPAC name of 6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole (CID 142604585) is 6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole.
What is the SMILES notation for 6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole?
The canonical SMILES for 6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole is C/C=C(\C)c1ccc2c(c1)c1c(n2-c2ccccc2)=CCCC=1.
What is the InChIKey of 6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole?
The InChIKey is QKNKRJHHHGMKBR-HQYXKAPLSA-N. The full InChI is InChI=1S/C22H21N/c1-3-16(2)17-13-14-22-20(15-17)19-11-7-8-12-21(19)23(22)18-9-5-4-6-10-18/h3-6,9-15H,7-8H2,1-2H3/b16-3+.
What are the key properties of 6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole?
6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole has a molecular weight of 299.42 g/mol, XLogP of 4.41, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(E)-but-2-en-2-yl]-9-phenyl-2,3-dihydrocarbazole is sourced from PubChem (CID 142604585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).