2-ethyl-1H-benzo[f]indole

C14H13N — CID 57138959

IUPAC2-ethyl-1H-benzo[f]indole
SMILESCCc1cc2cc3ccccc3cc2[nH]1
InChIInChI=1S/C14H13N/c1-2-13-8-12-7-10-5-3-4-6-11(10)9-14(12)15-13/h3-9,15H,2H2,1H3
InChIKeyIITLNPVTBUYAOR-UHFFFAOYSA-N
MW195.26 g/mol
LogP3.88
Rot. Bonds1

About 2-ethyl-1H-benzo[f]indole

2-ethyl-1H-benzo[f]indole (PubChem CID 57138959) has the molecular formula C14H13N and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-ethyl-1H-benzo[f]indole.

Molecular Properties

Compound Name2-ethyl-1H-benzo[f]indole
PubChem CID57138959
Molecular FormulaC14H13N
Molecular Weight195.26 g/mol
Exact Mass195.10
IUPAC Name2-ethyl-1H-benzo[f]indole
SMILESCCc1cc2cc3ccccc3cc2[nH]1
InChIInChI=1S/C14H13N/c1-2-13-8-12-7-10-5-3-4-6-11(10)9-14(12)15-13/h3-9,15H,2H2,1H3
InChIKeyIITLNPVTBUYAOR-UHFFFAOYSA-N
XLogP3.88
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

2-ethyl-6-methyl-1H-indole;molecular hydrogen;propane
CID 171834127
2-ethyl-5-propyl-1H-indole
CID 86257176
CID 132514226
CID 132514226
2-ethyl-6-methoxy-5-methyl-1H-indole
CID 130063718
3-methyl-1H-benzo[g]quinolin-2-one
CID 18347999
2-ethyl-1H-indole-5-carboxylic acid
CID 22708328
2-ethyl-5-methylsulfonyl-1H-indole
CID 139760314
4,15,21,32-tetrazaoctacyclo[16.16.0.03,16.05,14.07,12.020,33.022,31.024,29]tetratriaconta-1,3(16),5,7,9,11,13,17,19,22,24,26,28,30,33-pentadecaene
CID 132514224
2-heptyl-1H-indole
CID 3719004
ethane;2-ethyl-1H-pyrrolo[2,3-b]pyridine
CID 145385089
2-hexyl-1H-indole
CID 14299246
anthracene;ethanol;titanium
CID 160763576

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1H-benzo[f]indole?
The IUPAC name of 2-ethyl-1H-benzo[f]indole (CID 57138959) is 2-ethyl-1H-benzo[f]indole.
What is the SMILES notation for 2-ethyl-1H-benzo[f]indole?
The canonical SMILES for 2-ethyl-1H-benzo[f]indole is CCc1cc2cc3ccccc3cc2[nH]1.
What is the InChIKey of 2-ethyl-1H-benzo[f]indole?
The InChIKey is IITLNPVTBUYAOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N/c1-2-13-8-12-7-10-5-3-4-6-11(10)9-14(12)15-13/h3-9,15H,2H2,1H3.
What are the key properties of 2-ethyl-1H-benzo[f]indole?
2-ethyl-1H-benzo[f]indole has a molecular weight of 195.26 g/mol, XLogP of 3.88, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1H-benzo[f]indole is sourced from PubChem (CID 57138959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).