2-methoxy-6,7-dihydro-5H-indole

C9H11NO — CID 134249739

IUPAC2-methoxy-6,7-dihydro-5H-indole
SMILESCOC1=CC2=CCCCC2=N1
InChIInChI=1S/C9H11NO/c1-11-9-6-7-4-2-3-5-8(7)10-9/h4,6H,2-3,5H2,1H3
InChIKeyPMDKMEYIBOVWSE-UHFFFAOYSA-N
MW149.19 g/mol
LogP2.04
Rot. Bonds1

About 2-methoxy-6,7-dihydro-5H-indole

2-methoxy-6,7-dihydro-5H-indole (PubChem CID 134249739) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 2-methoxy-6,7-dihydro-5H-indole.

Molecular Properties

Compound Name2-methoxy-6,7-dihydro-5H-indole
PubChem CID134249739
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name2-methoxy-6,7-dihydro-5H-indole
SMILESCOC1=CC2=CCCCC2=N1
InChIInChI=1S/C9H11NO/c1-11-9-6-7-4-2-3-5-8(7)10-9/h4,6H,2-3,5H2,1H3
InChIKeyPMDKMEYIBOVWSE-UHFFFAOYSA-N
XLogP2.04
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(E)-(4-methylcyclopenta[b]pyridin-2-ylidene)methanolate
CID 138966761
2-methoxy-5H-indole
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6-methoxy-5H-indol-2-ol
CID 67918006
2-methoxy-7H-indole
CID 70467316
2-(Methoxymethylidene)indole
CID 175550272
lithium 2-but-3-enyl-6-methoxy-4H-pyridin-4-ide
CID 23691401
1-Benzazocin-2-YL methyl ether
CID 24209270
2-Methoxy-1-benzazocine
CID 85797092

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6,7-dihydro-5H-indole?
The IUPAC name of 2-methoxy-6,7-dihydro-5H-indole (CID 134249739) is 2-methoxy-6,7-dihydro-5H-indole.
What is the SMILES notation for 2-methoxy-6,7-dihydro-5H-indole?
The canonical SMILES for 2-methoxy-6,7-dihydro-5H-indole is COC1=CC2=CCCCC2=N1.
What is the InChIKey of 2-methoxy-6,7-dihydro-5H-indole?
The InChIKey is PMDKMEYIBOVWSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-11-9-6-7-4-2-3-5-8(7)10-9/h4,6H,2-3,5H2,1H3.
What are the key properties of 2-methoxy-6,7-dihydro-5H-indole?
2-methoxy-6,7-dihydro-5H-indole has a molecular weight of 149.19 g/mol, XLogP of 2.04, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6,7-dihydro-5H-indole is sourced from PubChem (CID 134249739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).