2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol

C15H23NO — CID 117203549

IUPAC2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol
SMILESCC(C)N1c2cc(C(C)(C)O)ccc2CC1C
InChIInChI=1S/C15H23NO/c1-10(2)16-11(3)8-12-6-7-13(9-14(12)16)15(4,5)17/h6-7,9-11,17H,8H2,1-5H3
InChIKeyLBIMQLLVNCQCLA-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.07
Rot. Bonds2

About 2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol

2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol (PubChem CID 117203549) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol.

Molecular Properties

Compound Name2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol
PubChem CID117203549
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol
SMILESCC(C)N1c2cc(C(C)(C)O)ccc2CC1C
InChIInChI=1S/C15H23NO/c1-10(2)16-11(3)8-12-6-7-13(9-14(12)16)15(4,5)17/h6-7,9-11,17H,8H2,1-5H3
InChIKeyLBIMQLLVNCQCLA-UHFFFAOYSA-N
XLogP3.07
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol?
The IUPAC name of 2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol (CID 117203549) is 2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol.
What is the SMILES notation for 2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol?
The canonical SMILES for 2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol is CC(C)N1c2cc(C(C)(C)O)ccc2CC1C.
What is the InChIKey of 2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol?
The InChIKey is LBIMQLLVNCQCLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-10(2)16-11(3)8-12-6-7-13(9-14(12)16)15(4,5)17/h6-7,9-11,17H,8H2,1-5H3.
What are the key properties of 2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol?
2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol has a molecular weight of 233.35 g/mol, XLogP of 3.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1-propan-2-yl-2,3-dihydroindol-6-yl)propan-2-ol is sourced from PubChem (CID 117203549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).