9H-pyrido[2,3-b]indole;2H-triazole

C13H11N5 — CID 67361735

IUPAC9H-pyrido[2,3-b]indole;2H-triazole
SMILESc1ccc2c(c1)[nH]c1ncccc12.c1cn[nH]n1
InChIInChI=1S/C11H8N2.C2H3N3/c1-2-6-10-8(4-1)9-5-3-7-12-11(9)13-10;1-2-4-5-3-1/h1-7H,(H,12,13);1-2H,(H,3,4,5)
InChIKeyHGGNVBIIKDOUDA-UHFFFAOYSA-N
MW237.27 g/mol
LogP2.52
Rot. Bonds

About 9H-pyrido[2,3-b]indole;2H-triazole

9H-pyrido[2,3-b]indole;2H-triazole (PubChem CID 67361735) has the molecular formula C13H11N5 and a molecular weight of 237.27 g/mol. Its IUPAC name is 9H-pyrido[2,3-b]indole;2H-triazole.

Molecular Properties

Compound Name9H-pyrido[2,3-b]indole;2H-triazole
PubChem CID67361735
Molecular FormulaC13H11N5
Molecular Weight237.27 g/mol
Exact Mass237.10
IUPAC Name9H-pyrido[2,3-b]indole;2H-triazole
SMILESc1ccc2c(c1)[nH]c1ncccc12.c1cn[nH]n1
InChIInChI=1S/C11H8N2.C2H3N3/c1-2-6-10-8(4-1)9-5-3-7-12-11(9)13-10;1-2-4-5-3-1/h1-7H,(H,12,13);1-2H,(H,3,4,5)
InChIKeyHGGNVBIIKDOUDA-UHFFFAOYSA-N
XLogP2.52
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.27
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9H-pyrido[2,3-b]indole;2H-triazole?
The IUPAC name of 9H-pyrido[2,3-b]indole;2H-triazole (CID 67361735) is 9H-pyrido[2,3-b]indole;2H-triazole.
What is the SMILES notation for 9H-pyrido[2,3-b]indole;2H-triazole?
The canonical SMILES for 9H-pyrido[2,3-b]indole;2H-triazole is c1ccc2c(c1)[nH]c1ncccc12.c1cn[nH]n1.
What is the InChIKey of 9H-pyrido[2,3-b]indole;2H-triazole?
The InChIKey is HGGNVBIIKDOUDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2.C2H3N3/c1-2-6-10-8(4-1)9-5-3-7-12-11(9)13-10;1-2-4-5-3-1/h1-7H,(H,12,13);1-2H,(H,3,4,5).
What are the key properties of 9H-pyrido[2,3-b]indole;2H-triazole?
9H-pyrido[2,3-b]indole;2H-triazole has a molecular weight of 237.27 g/mol, XLogP of 2.52, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-pyrido[2,3-b]indole;2H-triazole is sourced from PubChem (CID 67361735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).