9-(oxiran-2-ylmethyl)carbazole

C15H13NO — CID 2775507

IUPAC9-(oxiran-2-ylmethyl)carbazole
SMILESc1ccc2c(c1)c1ccccc1n2CC1CO1
InChIInChI=1S/C15H13NO/c1-3-7-14-12(5-1)13-6-2-4-8-15(13)16(14)9-11-10-17-11/h1-8,11H,9-10H2
InChIKeyVAJIZAPXBKMPRO-UHFFFAOYSA-N
MW223.28 g/mol
LogP3.19
Rot. Bonds2

About 9-(oxiran-2-ylmethyl)carbazole

9-(oxiran-2-ylmethyl)carbazole (PubChem CID 2775507) has the molecular formula C15H13NO and a molecular weight of 223.28 g/mol. Its IUPAC name is 9-(oxiran-2-ylmethyl)carbazole.

Molecular Properties

Compound Name9-(oxiran-2-ylmethyl)carbazole
PubChem CID2775507
Molecular FormulaC15H13NO
Molecular Weight223.28 g/mol
Exact Mass223.10
IUPAC Name9-(oxiran-2-ylmethyl)carbazole
SMILESc1ccc2c(c1)c1ccccc1n2CC1CO1
InChIInChI=1S/C15H13NO/c1-3-7-14-12(5-1)13-6-2-4-8-15(13)16(14)9-11-10-17-11/h1-8,11H,9-10H2
InChIKeyVAJIZAPXBKMPRO-UHFFFAOYSA-N
XLogP3.19
TPSA17.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-(oxiran-2-ylmethyl)carbazole?
The IUPAC name of 9-(oxiran-2-ylmethyl)carbazole (CID 2775507) is 9-(oxiran-2-ylmethyl)carbazole.
What is the SMILES notation for 9-(oxiran-2-ylmethyl)carbazole?
The canonical SMILES for 9-(oxiran-2-ylmethyl)carbazole is c1ccc2c(c1)c1ccccc1n2CC1CO1.
What is the InChIKey of 9-(oxiran-2-ylmethyl)carbazole?
The InChIKey is VAJIZAPXBKMPRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO/c1-3-7-14-12(5-1)13-6-2-4-8-15(13)16(14)9-11-10-17-11/h1-8,11H,9-10H2.
What are the key properties of 9-(oxiran-2-ylmethyl)carbazole?
9-(oxiran-2-ylmethyl)carbazole has a molecular weight of 223.28 g/mol, XLogP of 3.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(oxiran-2-ylmethyl)carbazole is sourced from PubChem (CID 2775507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).