2,6-di(propan-2-yl)-1H-indole

C14H19N — CID 59835911

IUPAC2,6-di(propan-2-yl)-1H-indole
SMILESCC(C)c1ccc2cc(C(C)C)[nH]c2c1
InChIInChI=1S/C14H19N/c1-9(2)11-5-6-12-8-13(10(3)4)15-14(12)7-11/h5-10,15H,1-4H3
InChIKeyVOHLSFJXHWRGSO-UHFFFAOYSA-N
MW201.31 g/mol
LogP4.41
Rot. Bonds2

About 2,6-di(propan-2-yl)-1H-indole

2,6-di(propan-2-yl)-1H-indole (PubChem CID 59835911) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is 2,6-di(propan-2-yl)-1H-indole.

Molecular Properties

Compound Name2,6-di(propan-2-yl)-1H-indole
PubChem CID59835911
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name2,6-di(propan-2-yl)-1H-indole
SMILESCC(C)c1ccc2cc(C(C)C)[nH]c2c1
InChIInChI=1S/C14H19N/c1-9(2)11-5-6-12-8-13(10(3)4)15-14(12)7-11/h5-10,15H,1-4H3
InChIKeyVOHLSFJXHWRGSO-UHFFFAOYSA-N
XLogP4.41
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

6-chloro-2-propan-2-yl-1H-indole;ethane
CID 176573496
2,6-di(propan-2-yl)-1H-benzimidazole;2,6-di(propan-2-yl)-1H-indole;tris(2,6-di(propan-2-yl)-3H-indole)
CID 159570245
2,5,6-tri(propan-2-yl)-1H-indole
CID 134294534
2,6-di(propan-2-yl)-1H-benzimidazole;bis(2,6-di(propan-2-yl)-1H-indole);bis(2,6-di(propan-2-yl)-3H-indole);methane
CID 161336227
N,N-dimethyl-6-propan-2-yl-1H-indole-2-carboxamide
CID 47186797
bis(2,6-ditert-butyl-3H-indole);bis(2,6-di(propan-2-yl)-1H-benzimidazole);2,6-di(propan-2-yl)-1H-indole
CID 161140157
2,6-di(propan-2-yl)naphthalene;ethane
CID 142320223
2,9-di(propan-2-yl)pentacene
CID 153380534
bis(6-tert-butyl-2-propan-2-yl-3H-indole);2,6-ditert-butyl-3H-indole;bis(2,6-di(propan-2-yl)-1H-benzimidazole);tris(2,6-di(propan-2-yl)-1H-indole)
CID 158523423
2-methyl-6-propan-2-yl-1H-benzimidazole
CID 21069154
5-propan-2-yl-1H-indole
CID 10558918
bis(2,6-ditert-butyl-3H-indole);2,6-di(propan-2-yl)-1H-benzimidazole;2,6-di(propan-2-yl)-1H-indole;2,6-di(propan-2-yl)-3H-indole
CID 159548511

Frequently Asked Questions

What is the IUPAC name of 2,6-di(propan-2-yl)-1H-indole?
The IUPAC name of 2,6-di(propan-2-yl)-1H-indole (CID 59835911) is 2,6-di(propan-2-yl)-1H-indole.
What is the SMILES notation for 2,6-di(propan-2-yl)-1H-indole?
The canonical SMILES for 2,6-di(propan-2-yl)-1H-indole is CC(C)c1ccc2cc(C(C)C)[nH]c2c1.
What is the InChIKey of 2,6-di(propan-2-yl)-1H-indole?
The InChIKey is VOHLSFJXHWRGSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-9(2)11-5-6-12-8-13(10(3)4)15-14(12)7-11/h5-10,15H,1-4H3.
What are the key properties of 2,6-di(propan-2-yl)-1H-indole?
2,6-di(propan-2-yl)-1H-indole has a molecular weight of 201.31 g/mol, XLogP of 4.41, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-di(propan-2-yl)-1H-indole is sourced from PubChem (CID 59835911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).