5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane]

C15H21N — CID 106701782

IUPAC5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane]
SMILESCC1CC12CNc1ccc(C(C)(C)C)cc12
InChIInChI=1S/C15H21N/c1-10-8-15(10)9-16-13-6-5-11(7-12(13)15)14(2,3)4/h5-7,10,16H,8-9H2,1-4H3
InChIKeyNOJJKWJFUWXENM-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.69
Rot. Bonds

About 5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane]

5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane] (PubChem CID 106701782) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane].

Molecular Properties

Compound Name5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane]
PubChem CID106701782
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane]
SMILESCC1CC12CNc1ccc(C(C)(C)C)cc12
InChIInChI=1S/C15H21N/c1-10-8-15(10)9-16-13-6-5-11(7-12(13)15)14(2,3)4/h5-7,10,16H,8-9H2,1-4H3
InChIKeyNOJJKWJFUWXENM-UHFFFAOYSA-N
XLogP3.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane] with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane]?
The IUPAC name of 5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane] (CID 106701782) is 5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane].
What is the SMILES notation for 5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane]?
The canonical SMILES for 5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane] is CC1CC12CNc1ccc(C(C)(C)C)cc12.
What is the InChIKey of 5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane]?
The InChIKey is NOJJKWJFUWXENM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-10-8-15(10)9-16-13-6-5-11(7-12(13)15)14(2,3)4/h5-7,10,16H,8-9H2,1-4H3.
What are the key properties of 5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane]?
5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane] has a molecular weight of 215.34 g/mol, XLogP of 3.69, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-2'-methylspiro[1,2-dihydroindole-3,1'-cyclopropane] is sourced from PubChem (CID 106701782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).