9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole

C17H14N4 — CID 175163330

IUPAC9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole
SMILESc1ccc2c(c1)c1ccccc1n2CCc1ncncn1
InChIInChI=1S/C17H14N4/c1-3-7-15-13(5-1)14-6-2-4-8-16(14)21(15)10-9-17-19-11-18-12-20-17/h1-8,11-12H,9-10H2
InChIKeyKZGBKOKETONZKQ-UHFFFAOYSA-N
MW274.33 g/mol
LogP3.22
Rot. Bonds3

About 9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole

9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole (PubChem CID 175163330) has the molecular formula C17H14N4 and a molecular weight of 274.33 g/mol. Its IUPAC name is 9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole.

Molecular Properties

Compound Name9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole
PubChem CID175163330
Molecular FormulaC17H14N4
Molecular Weight274.33 g/mol
Exact Mass274.12
IUPAC Name9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole
SMILESc1ccc2c(c1)c1ccccc1n2CCc1ncncn1
InChIInChI=1S/C17H14N4/c1-3-7-15-13(5-1)14-6-2-4-8-16(14)21(15)10-9-17-19-11-18-12-20-17/h1-8,11-12H,9-10H2
InChIKeyKZGBKOKETONZKQ-UHFFFAOYSA-N
XLogP3.22
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole?
The IUPAC name of 9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole (CID 175163330) is 9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole.
What is the SMILES notation for 9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole?
The canonical SMILES for 9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole is c1ccc2c(c1)c1ccccc1n2CCc1ncncn1.
What is the InChIKey of 9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole?
The InChIKey is KZGBKOKETONZKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4/c1-3-7-15-13(5-1)14-6-2-4-8-16(14)21(15)10-9-17-19-11-18-12-20-17/h1-8,11-12H,9-10H2.
What are the key properties of 9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole?
9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole has a molecular weight of 274.33 g/mol, XLogP of 3.22, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-(1,3,5-triazin-2-yl)ethyl]carbazole is sourced from PubChem (CID 175163330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).