(Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole

C31H33N — CID 144884443

IUPAC(Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole
SMILESC/C=C\C.CC.Cc1cccc2c3ccccc3n(-c3cccc(-c4ccccc4)c3)c12
InChIInChI=1S/C25H19N.C4H8.C2H6/c1-18-9-7-15-23-22-14-5-6-16-24(22)26(25(18)23)21-13-8-12-20(17-21)19-10-3-2-4-11-19;1-3-4-2;1-2/h2-17H,1H3;3-4H,1-2H3;1-2H3/b;4-3-;
InChIKeyQOCPJDJAVBPXIU-LWFKIUJUSA-N
MW419.61 g/mol
LogP9.37
Rot. Bonds2

About (Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole

(Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole (PubChem CID 144884443) has the molecular formula C31H33N and a molecular weight of 419.61 g/mol. Its IUPAC name is (Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole.

Molecular Properties

Compound Name(Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole
PubChem CID144884443
Molecular FormulaC31H33N
Molecular Weight419.61 g/mol
Exact Mass419.26
IUPAC Name(Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole
SMILESC/C=C\C.CC.Cc1cccc2c3ccccc3n(-c3cccc(-c4ccccc4)c3)c12
InChIInChI=1S/C25H19N.C4H8.C2H6/c1-18-9-7-15-23-22-14-5-6-16-24(22)26(25(18)23)21-13-8-12-20(17-21)19-10-3-2-4-11-19;1-3-4-2;1-2/h2-17H,1H3;3-4H,1-2H3;1-2H3/b;4-3-;
InChIKeyQOCPJDJAVBPXIU-LWFKIUJUSA-N
XLogP9.37
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500419.61
LogP ≤ 59.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

11-[3-(4-phenylphenyl)phenyl]-12-[3-[11-[3-(4-phenylphenyl)phenyl]indolo[2,3-a]carbazol-12-yl]phenyl]indolo[2,3-a]carbazole
CID 170394025
1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole
CID 137466576
11-phenyl-12-[9-(3-phenylphenyl)carbazol-1-yl]indolo[2,3-a]carbazole
CID 164800329
9-(3-methylphenyl)-18-[3-(4-phenylphenyl)phenyl]-9,18-diazahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene
CID 126501143
9-[3-[4-[4-[4-(3-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041263
9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole
CID 23386664
3,9-diphenyl-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 118449494
11-phenyl-12-[4-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]indolo[2,3-a]carbazole
CID 134168606
11-(9-phenylcarbazol-2-yl)-12-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole
CID 134168610
3-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)carbazole
CID 144639934
5-(3-phenylphenyl)-12-[3-(3-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 164847593
5,12-bis[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 122598848

Frequently Asked Questions

What is the IUPAC name of (Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole?
The IUPAC name of (Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole (CID 144884443) is (Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole.
What is the SMILES notation for (Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole?
The canonical SMILES for (Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole is C/C=C\C.CC.Cc1cccc2c3ccccc3n(-c3cccc(-c4ccccc4)c3)c12.
What is the InChIKey of (Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole?
The InChIKey is QOCPJDJAVBPXIU-LWFKIUJUSA-N. The full InChI is InChI=1S/C25H19N.C4H8.C2H6/c1-18-9-7-15-23-22-14-5-6-16-24(22)26(25(18)23)21-13-8-12-20(17-21)19-10-3-2-4-11-19;1-3-4-2;1-2/h2-17H,1H3;3-4H,1-2H3;1-2H3/b;4-3-;.
What are the key properties of (Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole?
(Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole has a molecular weight of 419.61 g/mol, XLogP of 9.37, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-but-2-ene;ethane;1-methyl-9-(3-phenylphenyl)carbazole is sourced from PubChem (CID 144884443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).