2-ethyl-4-methoxy-1H-benzo[g]indole

C15H15NO — CID 22381004

IUPAC2-ethyl-4-methoxy-1H-benzo[g]indole
SMILESCCc1cc2c(OC)cc3ccccc3c2[nH]1
InChIInChI=1S/C15H15NO/c1-3-11-9-13-14(17-2)8-10-6-4-5-7-12(10)15(13)16-11/h4-9,16H,3H2,1-2H3
InChIKeyWMSUNMXFONPQSW-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.89
Rot. Bonds2

About 2-ethyl-4-methoxy-1H-benzo[g]indole

2-ethyl-4-methoxy-1H-benzo[g]indole (PubChem CID 22381004) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 2-ethyl-4-methoxy-1H-benzo[g]indole.

Molecular Properties

Compound Name2-ethyl-4-methoxy-1H-benzo[g]indole
PubChem CID22381004
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name2-ethyl-4-methoxy-1H-benzo[g]indole
SMILESCCc1cc2c(OC)cc3ccccc3c2[nH]1
InChIInChI=1S/C15H15NO/c1-3-11-9-13-14(17-2)8-10-6-4-5-7-12(10)15(13)16-11/h4-9,16H,3H2,1-2H3
InChIKeyWMSUNMXFONPQSW-UHFFFAOYSA-N
XLogP3.89
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-methoxy-1H-benzo[g]indole?
The IUPAC name of 2-ethyl-4-methoxy-1H-benzo[g]indole (CID 22381004) is 2-ethyl-4-methoxy-1H-benzo[g]indole.
What is the SMILES notation for 2-ethyl-4-methoxy-1H-benzo[g]indole?
The canonical SMILES for 2-ethyl-4-methoxy-1H-benzo[g]indole is CCc1cc2c(OC)cc3ccccc3c2[nH]1.
What is the InChIKey of 2-ethyl-4-methoxy-1H-benzo[g]indole?
The InChIKey is WMSUNMXFONPQSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-3-11-9-13-14(17-2)8-10-6-4-5-7-12(10)15(13)16-11/h4-9,16H,3H2,1-2H3.
What are the key properties of 2-ethyl-4-methoxy-1H-benzo[g]indole?
2-ethyl-4-methoxy-1H-benzo[g]indole has a molecular weight of 225.29 g/mol, XLogP of 3.89, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-methoxy-1H-benzo[g]indole is sourced from PubChem (CID 22381004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).