9H-carbazole;1H-indole;pyridine

C25H21N3 — CID 161417632

IUPAC9H-carbazole;1H-indole;pyridine
SMILESc1ccc2[nH]ccc2c1.c1ccc2c(c1)[nH]c1ccccc12.c1ccncc1
InChIInChI=1S/C12H9N.C8H7N.C5H5N/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-4-8-7(3-1)5-6-9-8;1-2-4-6-5-3-1/h1-8,13H;1-6,9H;1-5H
InChIKeyVWHJBOCVXKNPIR-UHFFFAOYSA-N
MW363.46 g/mol
LogP6.57
Rot. Bonds

About 9H-carbazole;1H-indole;pyridine

9H-carbazole;1H-indole;pyridine (PubChem CID 161417632) has the molecular formula C25H21N3 and a molecular weight of 363.46 g/mol. Its IUPAC name is 9H-carbazole;1H-indole;pyridine.

Molecular Properties

Compound Name9H-carbazole;1H-indole;pyridine
PubChem CID161417632
Molecular FormulaC25H21N3
Molecular Weight363.46 g/mol
Exact Mass363.17
IUPAC Name9H-carbazole;1H-indole;pyridine
SMILESc1ccc2[nH]ccc2c1.c1ccc2c(c1)[nH]c1ccccc12.c1ccncc1
InChIInChI=1S/C12H9N.C8H7N.C5H5N/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-4-8-7(3-1)5-6-9-8;1-2-4-6-5-3-1/h1-8,13H;1-6,9H;1-5H
InChIKeyVWHJBOCVXKNPIR-UHFFFAOYSA-N
XLogP6.57
TPSA44.47 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.46
LogP ≤ 56.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9H-carbazole;1H-indole;pyridine?
The IUPAC name of 9H-carbazole;1H-indole;pyridine (CID 161417632) is 9H-carbazole;1H-indole;pyridine.
What is the SMILES notation for 9H-carbazole;1H-indole;pyridine?
The canonical SMILES for 9H-carbazole;1H-indole;pyridine is c1ccc2[nH]ccc2c1.c1ccc2c(c1)[nH]c1ccccc12.c1ccncc1.
What is the InChIKey of 9H-carbazole;1H-indole;pyridine?
The InChIKey is VWHJBOCVXKNPIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N.C8H7N.C5H5N/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-4-8-7(3-1)5-6-9-8;1-2-4-6-5-3-1/h1-8,13H;1-6,9H;1-5H.
What are the key properties of 9H-carbazole;1H-indole;pyridine?
9H-carbazole;1H-indole;pyridine has a molecular weight of 363.46 g/mol, XLogP of 6.57, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-carbazole;1H-indole;pyridine is sourced from PubChem (CID 161417632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).