6-methoxy-2,3-dihydro-1H-indole

C9H11NO — CID 6427549

IUPAC6-methoxy-2,3-dihydro-1H-indole
SMILESCOc1ccc2c(c1)NCC2
InChIInChI=1S/C9H11NO/c1-11-8-3-2-7-4-5-10-9(7)6-8/h2-3,6,10H,4-5H2,1H3
InChIKeyGKFGHNMPMAXWQS-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.66
Rot. Bonds1

About 6-methoxy-2,3-dihydro-1H-indole

6-methoxy-2,3-dihydro-1H-indole (PubChem CID 6427549) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 6-methoxy-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name6-methoxy-2,3-dihydro-1H-indole
PubChem CID6427549
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name6-methoxy-2,3-dihydro-1H-indole
SMILESCOc1ccc2c(c1)NCC2
InChIInChI=1S/C9H11NO/c1-11-8-3-2-7-4-5-10-9(7)6-8/h2-3,6,10H,4-5H2,1H3
InChIKeyGKFGHNMPMAXWQS-UHFFFAOYSA-N
XLogP1.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2,3-dihydro-1H-indole?
The IUPAC name of 6-methoxy-2,3-dihydro-1H-indole (CID 6427549) is 6-methoxy-2,3-dihydro-1H-indole.
What is the SMILES notation for 6-methoxy-2,3-dihydro-1H-indole?
The canonical SMILES for 6-methoxy-2,3-dihydro-1H-indole is COc1ccc2c(c1)NCC2.
What is the InChIKey of 6-methoxy-2,3-dihydro-1H-indole?
The InChIKey is GKFGHNMPMAXWQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-11-8-3-2-7-4-5-10-9(7)6-8/h2-3,6,10H,4-5H2,1H3.
What are the key properties of 6-methoxy-2,3-dihydro-1H-indole?
6-methoxy-2,3-dihydro-1H-indole has a molecular weight of 149.19 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2,3-dihydro-1H-indole is sourced from PubChem (CID 6427549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).