2H-benzo[g]indole

C12H9N — CID 57240257

IUPAC2H-benzo[g]indole
SMILESC1=c2ccc3ccccc3c2=NC1
InChIInChI=1S/C12H9N/c1-2-4-11-9(3-1)5-6-10-7-8-13-12(10)11/h1-7H,8H2
InChIKeyKVNORWKQOUHKTD-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.25
Rot. Bonds

About 2H-benzo[g]indole

2H-benzo[g]indole (PubChem CID 57240257) has the molecular formula C12H9N and a molecular weight of 167.21 g/mol. Its IUPAC name is 2H-benzo[g]indole.

Molecular Properties

Compound Name2H-benzo[g]indole
PubChem CID57240257
Molecular FormulaC12H9N
Molecular Weight167.21 g/mol
Exact Mass167.07
IUPAC Name2H-benzo[g]indole
SMILESC1=c2ccc3ccccc3c2=NC1
InChIInChI=1S/C12H9N/c1-2-4-11-9(3-1)5-6-10-7-8-13-12(10)11/h1-7H,8H2
InChIKeyKVNORWKQOUHKTD-UHFFFAOYSA-N
XLogP1.25
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2H-benzo[g]indole?
The IUPAC name of 2H-benzo[g]indole (CID 57240257) is 2H-benzo[g]indole.
What is the SMILES notation for 2H-benzo[g]indole?
The canonical SMILES for 2H-benzo[g]indole is C1=c2ccc3ccccc3c2=NC1.
What is the InChIKey of 2H-benzo[g]indole?
The InChIKey is KVNORWKQOUHKTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N/c1-2-4-11-9(3-1)5-6-10-7-8-13-12(10)11/h1-7H,8H2.
What are the key properties of 2H-benzo[g]indole?
2H-benzo[g]indole has a molecular weight of 167.21 g/mol, XLogP of 1.25, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-benzo[g]indole is sourced from PubChem (CID 57240257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).