2-ethoxy-3H-indole

C10H11NO — CID 23279270

IUPAC2-ethoxy-3H-indole
SMILESCCOC1=Nc2ccccc2C1
InChIInChI=1S/C10H11NO/c1-2-12-10-7-8-5-3-4-6-9(8)11-10/h3-6H,2,7H2,1H3
InChIKeyQEMOVVPIVSKMNI-UHFFFAOYSA-N
MW161.20 g/mol
LogP2.31
Rot. Bonds1

About 2-ethoxy-3H-indole

2-ethoxy-3H-indole (PubChem CID 23279270) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is 2-ethoxy-3H-indole.

Molecular Properties

Compound Name2-ethoxy-3H-indole
PubChem CID23279270
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name2-ethoxy-3H-indole
SMILESCCOC1=Nc2ccccc2C1
InChIInChI=1S/C10H11NO/c1-2-12-10-7-8-5-3-4-6-9(8)11-10/h3-6H,2,7H2,1H3
InChIKeyQEMOVVPIVSKMNI-UHFFFAOYSA-N
XLogP2.31
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-Methoxyethyl)aniline
CID 15208917
(4S)-2-tert-butyl-4-fluoro-4-methyl-5H-3,1-benzoxazepine
CID 132596944
2-Methyl-4H-3,1-benzoxazine
CID 10725495
6-Fluoro-2-methoxy-3,4-dihydroquinoline
CID 135069419
(4S)-4-fluoro-2,4-dimethyl-5H-3,1-benzoxazepine
CID 176438903
2-tert-butyl-4-fluoro-4-methyl-5H-3,1-benzoxazepine
CID 177855901
Cambridge id 5240446
CID 1375900
(1Z)-1-(2-methoxyindol-3-ylidene)-N,N-dimethylmethanamine
CID 1375901
2-(2-Methoxypropyl)aniline
CID 85901877
1-(2,2-Dimethoxy-ethyl)-2-isocyano-benzene
CID 11367514
2-Ethoxy-3,4-dihydroquinoline
CID 15812186
2-methoxy-4,5-dihydro-3H-1-benzazepine
CID 18428530

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3H-indole?
The IUPAC name of 2-ethoxy-3H-indole (CID 23279270) is 2-ethoxy-3H-indole.
What is the SMILES notation for 2-ethoxy-3H-indole?
The canonical SMILES for 2-ethoxy-3H-indole is CCOC1=Nc2ccccc2C1.
What is the InChIKey of 2-ethoxy-3H-indole?
The InChIKey is QEMOVVPIVSKMNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c1-2-12-10-7-8-5-3-4-6-9(8)11-10/h3-6H,2,7H2,1H3.
What are the key properties of 2-ethoxy-3H-indole?
2-ethoxy-3H-indole has a molecular weight of 161.20 g/mol, XLogP of 2.31, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3H-indole is sourced from PubChem (CID 23279270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).