1,2,2,3,3,4-hexamethylindole

C14H21N — CID 151055641

IUPAC1,2,2,3,3,4-hexamethylindole
SMILESCc1cccc2c1C(C)(C)C(C)(C)N2C
InChIInChI=1S/C14H21N/c1-10-8-7-9-11-12(10)13(2,3)14(4,5)15(11)6/h7-9H,1-6H3
InChIKeyMFBBRYONWSVVTO-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.50
Rot. Bonds

About 1,2,2,3,3,4-hexamethylindole

1,2,2,3,3,4-hexamethylindole (PubChem CID 151055641) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 1,2,2,3,3,4-hexamethylindole.

Molecular Properties

Compound Name1,2,2,3,3,4-hexamethylindole
PubChem CID151055641
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name1,2,2,3,3,4-hexamethylindole
SMILESCc1cccc2c1C(C)(C)C(C)(C)N2C
InChIInChI=1S/C14H21N/c1-10-8-7-9-11-12(10)13(2,3)14(4,5)15(11)6/h7-9H,1-6H3
InChIKeyMFBBRYONWSVVTO-UHFFFAOYSA-N
XLogP3.50
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,2,2,3,3,4-hexamethylindole?
The IUPAC name of 1,2,2,3,3,4-hexamethylindole (CID 151055641) is 1,2,2,3,3,4-hexamethylindole.
What is the SMILES notation for 1,2,2,3,3,4-hexamethylindole?
The canonical SMILES for 1,2,2,3,3,4-hexamethylindole is Cc1cccc2c1C(C)(C)C(C)(C)N2C.
What is the InChIKey of 1,2,2,3,3,4-hexamethylindole?
The InChIKey is MFBBRYONWSVVTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-10-8-7-9-11-12(10)13(2,3)14(4,5)15(11)6/h7-9H,1-6H3.
What are the key properties of 1,2,2,3,3,4-hexamethylindole?
1,2,2,3,3,4-hexamethylindole has a molecular weight of 203.33 g/mol, XLogP of 3.50, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,3,3,4-hexamethylindole is sourced from PubChem (CID 151055641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).