1-(2-methoxyethyl)-5-propan-2-yloxyindole

C14H19NO2 — CID 116625827

IUPAC1-(2-methoxyethyl)-5-propan-2-yloxyindole
SMILESCOCCn1ccc2cc(OC(C)C)ccc21
InChIInChI=1S/C14H19NO2/c1-11(2)17-13-4-5-14-12(10-13)6-7-15(14)8-9-16-3/h4-7,10-11H,8-9H2,1-3H3
InChIKeyBIXIZUJUFHHKIS-UHFFFAOYSA-N
MW233.31 g/mol
LogP3.07
Rot. Bonds5

About 1-(2-methoxyethyl)-5-propan-2-yloxyindole

1-(2-methoxyethyl)-5-propan-2-yloxyindole (PubChem CID 116625827) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-5-propan-2-yloxyindole.

Molecular Properties

Compound Name1-(2-methoxyethyl)-5-propan-2-yloxyindole
PubChem CID116625827
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name1-(2-methoxyethyl)-5-propan-2-yloxyindole
SMILESCOCCn1ccc2cc(OC(C)C)ccc21
InChIInChI=1S/C14H19NO2/c1-11(2)17-13-4-5-14-12(10-13)6-7-15(14)8-9-16-3/h4-7,10-11H,8-9H2,1-3H3
InChIKeyBIXIZUJUFHHKIS-UHFFFAOYSA-N
XLogP3.07
TPSA23.39 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-propan-2-yloxy-1-(2-propoxyethyl)indole
CID 106458095
1-(3-fluoropropyl)-5-propan-2-yloxyindole
CID 116625898
4-(5-propan-2-yloxyindol-1-yl)butan-1-amine
CID 80643163
1-(3-ethoxypropyl)-5-propan-2-yloxyindole
CID 116625752
1-(2-piperidin-1-ylethyl)-5-propan-2-yloxyindole
CID 116625738
N-propan-2-yl-3-(5-propan-2-yloxyindol-1-yl)propanamide
CID 116625781
1-(2-methoxyethyl)-5-methylindole
CID 116622979
5-propan-2-yloxy-1-prop-2-ynylindole
CID 116625801
5-methoxy-1-[3-(2-methoxyethoxy)propyl]indole
CID 103413319
1-(2-methoxyethyl)indol-5-ol
CID 138679498
1-(2,2-diethoxyethyl)-5-propan-2-yloxyindole
CID 80649265
5-ethyl-1-(2-methoxyethyl)indole
CID 71073272

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-5-propan-2-yloxyindole?
The IUPAC name of 1-(2-methoxyethyl)-5-propan-2-yloxyindole (CID 116625827) is 1-(2-methoxyethyl)-5-propan-2-yloxyindole.
What is the SMILES notation for 1-(2-methoxyethyl)-5-propan-2-yloxyindole?
The canonical SMILES for 1-(2-methoxyethyl)-5-propan-2-yloxyindole is COCCn1ccc2cc(OC(C)C)ccc21.
What is the InChIKey of 1-(2-methoxyethyl)-5-propan-2-yloxyindole?
The InChIKey is BIXIZUJUFHHKIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-11(2)17-13-4-5-14-12(10-13)6-7-15(14)8-9-16-3/h4-7,10-11H,8-9H2,1-3H3.
What are the key properties of 1-(2-methoxyethyl)-5-propan-2-yloxyindole?
1-(2-methoxyethyl)-5-propan-2-yloxyindole has a molecular weight of 233.31 g/mol, XLogP of 3.07, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-5-propan-2-yloxyindole is sourced from PubChem (CID 116625827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).