4-methyl-1-phenylindole

C15H13N — CID 138964714

IUPAC4-methyl-1-phenylindole
SMILESCc1cccc2c1ccn2-c1ccccc1
InChIInChI=1S/C15H13N/c1-12-6-5-9-15-14(12)10-11-16(15)13-7-3-2-4-8-13/h2-11H,1H3
InChIKeyLAMLXZSJJXDIJV-UHFFFAOYSA-N
MW207.28 g/mol
LogP3.94
Rot. Bonds1

About 4-methyl-1-phenylindole

4-methyl-1-phenylindole (PubChem CID 138964714) has the molecular formula C15H13N and a molecular weight of 207.28 g/mol. Its IUPAC name is 4-methyl-1-phenylindole.

Molecular Properties

Compound Name4-methyl-1-phenylindole
PubChem CID138964714
Molecular FormulaC15H13N
Molecular Weight207.28 g/mol
Exact Mass207.10
IUPAC Name4-methyl-1-phenylindole
SMILESCc1cccc2c1ccn2-c1ccccc1
InChIInChI=1S/C15H13N/c1-12-6-5-9-15-14(12)10-11-16(15)13-7-3-2-4-8-13/h2-11H,1H3
InChIKeyLAMLXZSJJXDIJV-UHFFFAOYSA-N
XLogP3.94
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-phenylindole?
The IUPAC name of 4-methyl-1-phenylindole (CID 138964714) is 4-methyl-1-phenylindole.
What is the SMILES notation for 4-methyl-1-phenylindole?
The canonical SMILES for 4-methyl-1-phenylindole is Cc1cccc2c1ccn2-c1ccccc1.
What is the InChIKey of 4-methyl-1-phenylindole?
The InChIKey is LAMLXZSJJXDIJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N/c1-12-6-5-9-15-14(12)10-11-16(15)13-7-3-2-4-8-13/h2-11H,1H3.
What are the key properties of 4-methyl-1-phenylindole?
4-methyl-1-phenylindole has a molecular weight of 207.28 g/mol, XLogP of 3.94, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-phenylindole is sourced from PubChem (CID 138964714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).