9-ethyl-1-pyrimidin-2-ylcarbazole

C18H15N3 — CID 91102631

IUPAC9-ethyl-1-pyrimidin-2-ylcarbazole
SMILESCCn1c2ccccc2c2cccc(-c3ncccn3)c21
InChIInChI=1S/C18H15N3/c1-2-21-16-10-4-3-7-13(16)14-8-5-9-15(17(14)21)18-19-11-6-12-20-18/h3-12H,2H2,1H3
InChIKeyKGKMKHJZCATUPE-UHFFFAOYSA-N
MW273.34 g/mol
LogP4.27
Rot. Bonds2

About 9-ethyl-1-pyrimidin-2-ylcarbazole

9-ethyl-1-pyrimidin-2-ylcarbazole (PubChem CID 91102631) has the molecular formula C18H15N3 and a molecular weight of 273.34 g/mol. Its IUPAC name is 9-ethyl-1-pyrimidin-2-ylcarbazole.

Molecular Properties

Compound Name9-ethyl-1-pyrimidin-2-ylcarbazole
PubChem CID91102631
Molecular FormulaC18H15N3
Molecular Weight273.34 g/mol
Exact Mass273.13
IUPAC Name9-ethyl-1-pyrimidin-2-ylcarbazole
SMILESCCn1c2ccccc2c2cccc(-c3ncccn3)c21
InChIInChI=1S/C18H15N3/c1-2-21-16-10-4-3-7-13(16)14-8-5-9-15(17(14)21)18-19-11-6-12-20-18/h3-12H,2H2,1H3
InChIKeyKGKMKHJZCATUPE-UHFFFAOYSA-N
XLogP4.27
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-1-pyrimidin-2-ylcarbazole?
The IUPAC name of 9-ethyl-1-pyrimidin-2-ylcarbazole (CID 91102631) is 9-ethyl-1-pyrimidin-2-ylcarbazole.
What is the SMILES notation for 9-ethyl-1-pyrimidin-2-ylcarbazole?
The canonical SMILES for 9-ethyl-1-pyrimidin-2-ylcarbazole is CCn1c2ccccc2c2cccc(-c3ncccn3)c21.
What is the InChIKey of 9-ethyl-1-pyrimidin-2-ylcarbazole?
The InChIKey is KGKMKHJZCATUPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3/c1-2-21-16-10-4-3-7-13(16)14-8-5-9-15(17(14)21)18-19-11-6-12-20-18/h3-12H,2H2,1H3.
What are the key properties of 9-ethyl-1-pyrimidin-2-ylcarbazole?
9-ethyl-1-pyrimidin-2-ylcarbazole has a molecular weight of 273.34 g/mol, XLogP of 4.27, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-1-pyrimidin-2-ylcarbazole is sourced from PubChem (CID 91102631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).