ethyl 2-carbazol-9-ylprop-2-enoate

C17H15NO2 — CID 23150324

IUPACethyl 2-carbazol-9-ylprop-2-enoate
SMILESC=C(C(=O)OCC)n1c2ccccc2c2ccccc21
InChIInChI=1S/C17H15NO2/c1-3-20-17(19)12(2)18-15-10-6-4-8-13(15)14-9-5-7-11-16(14)18/h4-11H,2-3H2,1H3
InChIKeyIDHDLGGJFRLSJD-UHFFFAOYSA-N
MW265.31 g/mol
LogP3.83
Rot. Bonds3

About ethyl 2-carbazol-9-ylprop-2-enoate

ethyl 2-carbazol-9-ylprop-2-enoate (PubChem CID 23150324) has the molecular formula C17H15NO2 and a molecular weight of 265.31 g/mol. Its IUPAC name is ethyl 2-carbazol-9-ylprop-2-enoate.

Molecular Properties

Compound Nameethyl 2-carbazol-9-ylprop-2-enoate
PubChem CID23150324
Molecular FormulaC17H15NO2
Molecular Weight265.31 g/mol
Exact Mass265.11
IUPAC Nameethyl 2-carbazol-9-ylprop-2-enoate
SMILESC=C(C(=O)OCC)n1c2ccccc2c2ccccc21
InChIInChI=1S/C17H15NO2/c1-3-20-17(19)12(2)18-15-10-6-4-8-13(15)14-9-5-7-11-16(14)18/h4-11H,2-3H2,1H3
InChIKeyIDHDLGGJFRLSJD-UHFFFAOYSA-N
XLogP3.83
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-carbazol-9-ylprop-2-enoate?
The IUPAC name of ethyl 2-carbazol-9-ylprop-2-enoate (CID 23150324) is ethyl 2-carbazol-9-ylprop-2-enoate.
What is the SMILES notation for ethyl 2-carbazol-9-ylprop-2-enoate?
The canonical SMILES for ethyl 2-carbazol-9-ylprop-2-enoate is C=C(C(=O)OCC)n1c2ccccc2c2ccccc21.
What is the InChIKey of ethyl 2-carbazol-9-ylprop-2-enoate?
The InChIKey is IDHDLGGJFRLSJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2/c1-3-20-17(19)12(2)18-15-10-6-4-8-13(15)14-9-5-7-11-16(14)18/h4-11H,2-3H2,1H3.
What are the key properties of ethyl 2-carbazol-9-ylprop-2-enoate?
ethyl 2-carbazol-9-ylprop-2-enoate has a molecular weight of 265.31 g/mol, XLogP of 3.83, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-carbazol-9-ylprop-2-enoate is sourced from PubChem (CID 23150324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).