4-cyclopropyloxy-2-ethyl-1H-indole

C13H15NO — CID 167080162

IUPAC4-cyclopropyloxy-2-ethyl-1H-indole
SMILESCCc1cc2c(OC3CC3)cccc2[nH]1
InChIInChI=1S/C13H15NO/c1-2-9-8-11-12(14-9)4-3-5-13(11)15-10-6-7-10/h3-5,8,10,14H,2,6-7H2,1H3
InChIKeyIIZLRTSANGTRMH-UHFFFAOYSA-N
MW201.27 g/mol
LogP3.27
Rot. Bonds3

About 4-cyclopropyloxy-2-ethyl-1H-indole

4-cyclopropyloxy-2-ethyl-1H-indole (PubChem CID 167080162) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-cyclopropyloxy-2-ethyl-1H-indole.

Molecular Properties

Compound Name4-cyclopropyloxy-2-ethyl-1H-indole
PubChem CID167080162
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name4-cyclopropyloxy-2-ethyl-1H-indole
SMILESCCc1cc2c(OC3CC3)cccc2[nH]1
InChIInChI=1S/C13H15NO/c1-2-9-8-11-12(14-9)4-3-5-13(11)15-10-6-7-10/h3-5,8,10,14H,2,6-7H2,1H3
InChIKeyIIZLRTSANGTRMH-UHFFFAOYSA-N
XLogP3.27
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyloxy-2-ethyl-1H-indole?
The IUPAC name of 4-cyclopropyloxy-2-ethyl-1H-indole (CID 167080162) is 4-cyclopropyloxy-2-ethyl-1H-indole.
What is the SMILES notation for 4-cyclopropyloxy-2-ethyl-1H-indole?
The canonical SMILES for 4-cyclopropyloxy-2-ethyl-1H-indole is CCc1cc2c(OC3CC3)cccc2[nH]1.
What is the InChIKey of 4-cyclopropyloxy-2-ethyl-1H-indole?
The InChIKey is IIZLRTSANGTRMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-2-9-8-11-12(14-9)4-3-5-13(11)15-10-6-7-10/h3-5,8,10,14H,2,6-7H2,1H3.
What are the key properties of 4-cyclopropyloxy-2-ethyl-1H-indole?
4-cyclopropyloxy-2-ethyl-1H-indole has a molecular weight of 201.27 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyloxy-2-ethyl-1H-indole is sourced from PubChem (CID 167080162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).