9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine

C20H22N2 — CID 135010823

IUPAC9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine
SMILESC=CCNc1ccc2c(c1CC=C)c1ccccc1n2CC
InChIInChI=1S/C20H22N2/c1-4-9-15-17(21-14-5-2)12-13-19-20(15)16-10-7-8-11-18(16)22(19)6-3/h4-5,7-8,10-13,21H,1-2,6,9,14H2,3H3
InChIKeyOPUOYDMTQMQXNO-UHFFFAOYSA-N
MW290.41 g/mol
LogP5.14
Rot. Bonds6

About 9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine

9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine (PubChem CID 135010823) has the molecular formula C20H22N2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine.

Molecular Properties

Compound Name9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine
PubChem CID135010823
Molecular FormulaC20H22N2
Molecular Weight290.41 g/mol
Exact Mass290.18
IUPAC Name9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine
SMILESC=CCNc1ccc2c(c1CC=C)c1ccccc1n2CC
InChIInChI=1S/C20H22N2/c1-4-9-15-17(21-14-5-2)12-13-19-20(15)16-10-7-8-11-18(16)22(19)6-3/h4-5,7-8,10-13,21H,1-2,6,9,14H2,3H3
InChIKeyOPUOYDMTQMQXNO-UHFFFAOYSA-N
XLogP5.14
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.41
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine?
The IUPAC name of 9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine (CID 135010823) is 9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine.
What is the SMILES notation for 9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine?
The canonical SMILES for 9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine is C=CCNc1ccc2c(c1CC=C)c1ccccc1n2CC.
What is the InChIKey of 9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine?
The InChIKey is OPUOYDMTQMQXNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2/c1-4-9-15-17(21-14-5-2)12-13-19-20(15)16-10-7-8-11-18(16)22(19)6-3/h4-5,7-8,10-13,21H,1-2,6,9,14H2,3H3.
What are the key properties of 9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine?
9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine has a molecular weight of 290.41 g/mol, XLogP of 5.14, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-N,4-bis(prop-2-enyl)carbazol-3-amine is sourced from PubChem (CID 135010823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).