2-but-2-enyl-2,3,4-trimethylcarbazole

C19H21N — CID 87320214

IUPAC2-but-2-enyl-2,3,4-trimethylcarbazole
SMILESCC=CCC1(C)C=C2N=c3ccccc3=C2C(C)=C1C
InChIInChI=1S/C19H21N/c1-5-6-11-19(4)12-17-18(13(2)14(19)3)15-9-7-8-10-16(15)20-17/h5-10,12H,11H2,1-4H3
InChIKeyMEURTEKKIBZNIG-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.68
Rot. Bonds2

About 2-but-2-enyl-2,3,4-trimethylcarbazole

2-but-2-enyl-2,3,4-trimethylcarbazole (PubChem CID 87320214) has the molecular formula C19H21N and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-but-2-enyl-2,3,4-trimethylcarbazole.

Molecular Properties

Compound Name2-but-2-enyl-2,3,4-trimethylcarbazole
PubChem CID87320214
Molecular FormulaC19H21N
Molecular Weight263.38 g/mol
Exact Mass263.17
IUPAC Name2-but-2-enyl-2,3,4-trimethylcarbazole
SMILESCC=CCC1(C)C=C2N=c3ccccc3=C2C(C)=C1C
InChIInChI=1S/C19H21N/c1-5-6-11-19(4)12-17-18(13(2)14(19)3)15-9-7-8-10-16(15)20-17/h5-10,12H,11H2,1-4H3
InChIKeyMEURTEKKIBZNIG-UHFFFAOYSA-N
XLogP3.68
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-but-2-enyl-2,3,4-trimethylcarbazole 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

4H-Carbazole
CID 19360791
2,2-Dimethylcarbazole
CID 18471893
4,4-Dimethylcarbazole
CID 20098137
21-Azapentacyclo[12.7.0.02,7.07,12.015,20]henicosa-1,3,5,8,10,12,14,16,18,20-decaene
CID 20512480
2,2,3-Trimethyl-4-propylcarbazole
CID 21480324
2,2,3-Trimethylcarbazole
CID 21880529
Spiro[carbazole-2,1'-cyclohexane]
CID 21886814
3,4,4-Trimethylcarbazole
CID 22250977
13-Azatetracyclo[12.4.0.01,6.07,12]octadeca-2,4,6,9,11,13,15,17-octaene
CID 53667089
CID 57759473
CID 57759473
potassium 2,3,3-trimethyl-5H-indol-5-ide
CID 58220092
sodium 2,3,3-trimethyl-5H-indol-5-ide
CID 58567027

Frequently Asked Questions

What is the IUPAC name of 2-but-2-enyl-2,3,4-trimethylcarbazole?
The IUPAC name of 2-but-2-enyl-2,3,4-trimethylcarbazole (CID 87320214) is 2-but-2-enyl-2,3,4-trimethylcarbazole.
What is the SMILES notation for 2-but-2-enyl-2,3,4-trimethylcarbazole?
The canonical SMILES for 2-but-2-enyl-2,3,4-trimethylcarbazole is CC=CCC1(C)C=C2N=c3ccccc3=C2C(C)=C1C.
What is the InChIKey of 2-but-2-enyl-2,3,4-trimethylcarbazole?
The InChIKey is MEURTEKKIBZNIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N/c1-5-6-11-19(4)12-17-18(13(2)14(19)3)15-9-7-8-10-16(15)20-17/h5-10,12H,11H2,1-4H3.
What are the key properties of 2-but-2-enyl-2,3,4-trimethylcarbazole?
2-but-2-enyl-2,3,4-trimethylcarbazole has a molecular weight of 263.38 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-but-2-enyl-2,3,4-trimethylcarbazole is sourced from PubChem (CID 87320214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).