(E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine

C30H28N2 — CID 143224441

IUPAC(E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine
SMILESCCC/C=C(/N)Cc1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C30H28N2/c1-2-3-8-25(31)21-22-13-15-23(16-14-22)24-17-19-26(20-18-24)32-29-11-6-4-9-27(29)28-10-5-7-12-30(28)32/h4-20H,2-3,21,31H2,1H3/b25-8+
InChIKeyHLIDPIYUKYPROA-ZNLRHDTNSA-N
MW416.57 g/mol
LogP7.64
Rot. Bonds6

About (E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine

(E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine (PubChem CID 143224441) has the molecular formula C30H28N2 and a molecular weight of 416.57 g/mol. Its IUPAC name is (E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine.

Molecular Properties

Compound Name(E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine
PubChem CID143224441
Molecular FormulaC30H28N2
Molecular Weight416.57 g/mol
Exact Mass416.23
IUPAC Name(E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine
SMILESCCC/C=C(/N)Cc1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C30H28N2/c1-2-3-8-25(31)21-22-13-15-23(16-14-22)24-17-19-26(20-18-24)32-29-11-6-4-9-27(29)28-10-5-7-12-30(28)32/h4-20H,2-3,21,31H2,1H3/b25-8+
InChIKeyHLIDPIYUKYPROA-ZNLRHDTNSA-N
XLogP7.64
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.57
LogP ≤ 57.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[9-[4-[4-[3-(hydroxymethyl)carbazol-9-yl]phenyl]phenyl]carbazol-3-yl]methanol
CID 58625620
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;ethane
CID 143126318
9-[4-[4-[4-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041201
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole
CID 135323607
9-(4-phenylphenyl)-3-[4-[4-[(4-phenylphenyl)methyl]phenyl]phenyl]carbazole
CID 158819686
9-[4-(4-methoxyphenyl)phenyl]carbazole
CID 58905910
N,4-bis(4-carbazol-9-ylphenyl)-N-[4-(4-carbazol-9-ylphenyl)phenyl]aniline
CID 20608008
3-[4-[(Z)-2,3-diphenylprop-2-enyl]phenyl]-9-phenylcarbazole
CID 146661084
9-(4-butylphenyl)-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 163903365
2-methylpentan-2-yl 2-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]acetate
CID 163588358
5-phenyl-11-[4-(4-phenylphenyl)phenyl]indolo[3,2-b]carbazole
CID 142356573
3-carbazol-9-yl-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 149208011

Frequently Asked Questions

What is the IUPAC name of (E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine?
The IUPAC name of (E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine (CID 143224441) is (E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine.
What is the SMILES notation for (E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine?
The canonical SMILES for (E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine is CCC/C=C(/N)Cc1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.
What is the InChIKey of (E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine?
The InChIKey is HLIDPIYUKYPROA-ZNLRHDTNSA-N. The full InChI is InChI=1S/C30H28N2/c1-2-3-8-25(31)21-22-13-15-23(16-14-22)24-17-19-26(20-18-24)32-29-11-6-4-9-27(29)28-10-5-7-12-30(28)32/h4-20H,2-3,21,31H2,1H3/b25-8+.
What are the key properties of (E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine?
(E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine has a molecular weight of 416.57 g/mol, XLogP of 7.64, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-[4-(4-carbazol-9-ylphenyl)phenyl]hex-2-en-2-amine is sourced from PubChem (CID 143224441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).