2-prop-2-enoxy-9H-carbazole

C15H13NO — CID 66553613

IUPAC2-prop-2-enoxy-9H-carbazole
SMILESC=CCOc1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C15H13NO/c1-2-9-17-11-7-8-13-12-5-3-4-6-14(12)16-15(13)10-11/h2-8,10,16H,1,9H2
InChIKeyBSVXFZYGBHIGIN-UHFFFAOYSA-N
MW223.27 g/mol
LogP3.89
Rot. Bonds3

About 2-prop-2-enoxy-9H-carbazole

2-prop-2-enoxy-9H-carbazole (PubChem CID 66553613) has the molecular formula C15H13NO and a molecular weight of 223.27 g/mol. Its IUPAC name is 2-prop-2-enoxy-9H-carbazole.

Molecular Properties

Compound Name2-prop-2-enoxy-9H-carbazole
PubChem CID66553613
Molecular FormulaC15H13NO
Molecular Weight223.27 g/mol
Exact Mass223.10
IUPAC Name2-prop-2-enoxy-9H-carbazole
SMILESC=CCOc1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C15H13NO/c1-2-9-17-11-7-8-13-12-5-3-4-6-14(12)16-15(13)10-11/h2-8,10,16H,1,9H2
InChIKeyBSVXFZYGBHIGIN-UHFFFAOYSA-N
XLogP3.89
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enoxy-9H-carbazole?
The IUPAC name of 2-prop-2-enoxy-9H-carbazole (CID 66553613) is 2-prop-2-enoxy-9H-carbazole.
What is the SMILES notation for 2-prop-2-enoxy-9H-carbazole?
The canonical SMILES for 2-prop-2-enoxy-9H-carbazole is C=CCOc1ccc2c(c1)[nH]c1ccccc12.
What is the InChIKey of 2-prop-2-enoxy-9H-carbazole?
The InChIKey is BSVXFZYGBHIGIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO/c1-2-9-17-11-7-8-13-12-5-3-4-6-14(12)16-15(13)10-11/h2-8,10,16H,1,9H2.
What are the key properties of 2-prop-2-enoxy-9H-carbazole?
2-prop-2-enoxy-9H-carbazole has a molecular weight of 223.27 g/mol, XLogP of 3.89, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enoxy-9H-carbazole is sourced from PubChem (CID 66553613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).