4,6-di(propan-2-yl)-2,3-dihydro-1H-indole

C14H21N — CID 14344795

IUPAC4,6-di(propan-2-yl)-2,3-dihydro-1H-indole
SMILESCC(C)c1cc2c(c(C(C)C)c1)CCN2
InChIInChI=1S/C14H21N/c1-9(2)11-7-13(10(3)4)12-5-6-15-14(12)8-11/h7-10,15H,5-6H2,1-4H3
InChIKeyKCFNVSDOFPZTER-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.90
Rot. Bonds2

About 4,6-di(propan-2-yl)-2,3-dihydro-1H-indole

4,6-di(propan-2-yl)-2,3-dihydro-1H-indole (PubChem CID 14344795) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 4,6-di(propan-2-yl)-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name4,6-di(propan-2-yl)-2,3-dihydro-1H-indole
PubChem CID14344795
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name4,6-di(propan-2-yl)-2,3-dihydro-1H-indole
SMILESCC(C)c1cc2c(c(C(C)C)c1)CCN2
InChIInChI=1S/C14H21N/c1-9(2)11-7-13(10(3)4)12-5-6-15-14(12)8-11/h7-10,15H,5-6H2,1-4H3
InChIKeyKCFNVSDOFPZTER-UHFFFAOYSA-N
XLogP3.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4,6-di(propan-2-yl)-2,3-dihydro-1H-indole?
The IUPAC name of 4,6-di(propan-2-yl)-2,3-dihydro-1H-indole (CID 14344795) is 4,6-di(propan-2-yl)-2,3-dihydro-1H-indole.
What is the SMILES notation for 4,6-di(propan-2-yl)-2,3-dihydro-1H-indole?
The canonical SMILES for 4,6-di(propan-2-yl)-2,3-dihydro-1H-indole is CC(C)c1cc2c(c(C(C)C)c1)CCN2.
What is the InChIKey of 4,6-di(propan-2-yl)-2,3-dihydro-1H-indole?
The InChIKey is KCFNVSDOFPZTER-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-9(2)11-7-13(10(3)4)12-5-6-15-14(12)8-11/h7-10,15H,5-6H2,1-4H3.
What are the key properties of 4,6-di(propan-2-yl)-2,3-dihydro-1H-indole?
4,6-di(propan-2-yl)-2,3-dihydro-1H-indole has a molecular weight of 203.33 g/mol, XLogP of 3.90, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-di(propan-2-yl)-2,3-dihydro-1H-indole is sourced from PubChem (CID 14344795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).