7-methyl-2H-indole

C9H9N — CID 13640031

IUPAC7-methyl-2H-indole
SMILESCC1=CC=CC2=CCN=C12
InChIInChI=1S/C9H9N/c1-7-3-2-4-8-5-6-10-9(7)8/h2-5H,6H2,1H3
InChIKeyDTYNOYRZARBYGA-UHFFFAOYSA-N
MW131.17 g/mol
LogP1.60
Rot. Bonds

About 7-methyl-2H-indole

7-methyl-2H-indole (PubChem CID 13640031) has the molecular formula C9H9N and a molecular weight of 131.17 g/mol. Its IUPAC name is 7-methyl-2H-indole.

Molecular Properties

Compound Name7-methyl-2H-indole
PubChem CID13640031
Molecular FormulaC9H9N
Molecular Weight131.17 g/mol
Exact Mass131.07
IUPAC Name7-methyl-2H-indole
SMILESCC1=CC=CC2=CCN=C12
InChIInChI=1S/C9H9N/c1-7-3-2-4-8-5-6-10-9(7)8/h2-5H,6H2,1H3
InChIKeyDTYNOYRZARBYGA-UHFFFAOYSA-N
XLogP1.60
TPSA12.40 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity277

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.17
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

8aH-carbazole
CID 9548747
2H-Indole
CID 19013146
2-Methylindol-2-ylium
CID 57054412
2-methyl-2H-indole
CID 58371059
Trimethyl 2h indol
CID 101318478
5-fluoro-2H-indole
CID 69725021
2-fluoro-2H-indole
CID 69725022
5-[(2Z,4E)-4-fluorohexa-2,4-dienyl]-3-methyl-2H-pyrrole
CID 143331085
5-fluoro-2-methyl-2H-indole
CID 173150045
N-(1-fluoroethyl)-6-methylidenecyclohexa-2,4-dien-1-imine
CID 173813481
2-ethyl-5-fluoro-2H-indole
CID 175232011
Tetrahydrodicyclopenta-[b,e]pyridine
CID 129776972

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2H-indole?
The IUPAC name of 7-methyl-2H-indole (CID 13640031) is 7-methyl-2H-indole.
What is the SMILES notation for 7-methyl-2H-indole?
The canonical SMILES for 7-methyl-2H-indole is CC1=CC=CC2=CCN=C12.
What is the InChIKey of 7-methyl-2H-indole?
The InChIKey is DTYNOYRZARBYGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N/c1-7-3-2-4-8-5-6-10-9(7)8/h2-5H,6H2,1H3.
What are the key properties of 7-methyl-2H-indole?
7-methyl-2H-indole has a molecular weight of 131.17 g/mol, XLogP of 1.60, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2H-indole is sourced from PubChem (CID 13640031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).