5-(thiophen-2-ylmethoxy)-1H-indole

C13H11NOS — CID 18797477

IUPAC5-(thiophen-2-ylmethoxy)-1H-indole
SMILESc1csc(COc2ccc3[nH]ccc3c2)c1
InChIInChI=1S/C13H11NOS/c1-2-12(16-7-1)9-15-11-3-4-13-10(8-11)5-6-14-13/h1-8,14H,9H2
InChIKeyKIZXQSVIQFZFIN-UHFFFAOYSA-N
MW229.30 g/mol
LogP3.81
Rot. Bonds3

About 5-(thiophen-2-ylmethoxy)-1H-indole

5-(thiophen-2-ylmethoxy)-1H-indole (PubChem CID 18797477) has the molecular formula C13H11NOS and a molecular weight of 229.30 g/mol. Its IUPAC name is 5-(thiophen-2-ylmethoxy)-1H-indole.

Molecular Properties

Compound Name5-(thiophen-2-ylmethoxy)-1H-indole
PubChem CID18797477
Molecular FormulaC13H11NOS
Molecular Weight229.30 g/mol
Exact Mass229.06
IUPAC Name5-(thiophen-2-ylmethoxy)-1H-indole
SMILESc1csc(COc2ccc3[nH]ccc3c2)c1
InChIInChI=1S/C13H11NOS/c1-2-12(16-7-1)9-15-11-3-4-13-10(8-11)5-6-14-13/h1-8,14H,9H2
InChIKeyKIZXQSVIQFZFIN-UHFFFAOYSA-N
XLogP3.81
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 43326496
2-(1H-indol-5-yloxy)ethanamine
CID 84655544
3-(thiophen-2-ylmethoxy)phenol
CID 43143563
4-(1H-indol-5-yloxymethyl)quinoline
CID 80648654
5-[(2-chloro-6-fluorophenyl)methoxy]-1H-indole
CID 80642309
5-[(2,5-dimethylphenyl)methoxy]-1H-indole
CID 80642432
5-[(2-butoxyphenyl)methoxy]-1H-indole
CID 67917034
5-heptoxy-1H-indole
CID 80642434
5-[2-(4-bromophenoxy)ethoxy]-1H-indole
CID 80640825
3-(1H-indol-5-yloxymethyl)-5-(methoxymethyl)-1,2-oxazole
CID 80643447
3-(1H-indol-5-yloxymethyl)benzamide
CID 80641446
2-[[4-(bromomethyl)phenoxy]methyl]thiophene
CID 43141545

Frequently Asked Questions

What is the IUPAC name of 5-(thiophen-2-ylmethoxy)-1H-indole?
The IUPAC name of 5-(thiophen-2-ylmethoxy)-1H-indole (CID 18797477) is 5-(thiophen-2-ylmethoxy)-1H-indole.
What is the SMILES notation for 5-(thiophen-2-ylmethoxy)-1H-indole?
The canonical SMILES for 5-(thiophen-2-ylmethoxy)-1H-indole is c1csc(COc2ccc3[nH]ccc3c2)c1.
What is the InChIKey of 5-(thiophen-2-ylmethoxy)-1H-indole?
The InChIKey is KIZXQSVIQFZFIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NOS/c1-2-12(16-7-1)9-15-11-3-4-13-10(8-11)5-6-14-13/h1-8,14H,9H2.
What are the key properties of 5-(thiophen-2-ylmethoxy)-1H-indole?
5-(thiophen-2-ylmethoxy)-1H-indole has a molecular weight of 229.30 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(thiophen-2-ylmethoxy)-1H-indole is sourced from PubChem (CID 18797477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).