(8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane

C24H35NSi — CID 140802078

IUPAC(8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane
SMILESCC1C2C=CC=CC2C2C1c1cc(C(C)(C)C)ccc1N2C[Si](C)(C)C
InChIInChI=1S/C24H35NSi/c1-16-18-10-8-9-11-19(18)23-22(16)20-14-17(24(2,3)4)12-13-21(20)25(23)15-26(5,6)7/h8-14,16,18-19,22-23H,15H2,1-7H3
InChIKeyYEJFPFXMJUFXKM-UHFFFAOYSA-N
MW365.64 g/mol
LogP6.14
Rot. Bonds2

About (8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane

(8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane (PubChem CID 140802078) has the molecular formula C24H35NSi and a molecular weight of 365.64 g/mol. Its IUPAC name is (8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane.

Molecular Properties

Compound Name(8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane
PubChem CID140802078
Molecular FormulaC24H35NSi
Molecular Weight365.64 g/mol
Exact Mass365.25
IUPAC Name(8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane
SMILESCC1C2C=CC=CC2C2C1c1cc(C(C)(C)C)ccc1N2C[Si](C)(C)C
InChIInChI=1S/C24H35NSi/c1-16-18-10-8-9-11-19(18)23-22(16)20-14-17(24(2,3)4)12-13-21(20)25(23)15-26(5,6)7/h8-14,16,18-19,22-23H,15H2,1-7H3
InChIKeyYEJFPFXMJUFXKM-UHFFFAOYSA-N
XLogP6.14
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.64
LogP ≤ 56.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane?
The IUPAC name of (8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane (CID 140802078) is (8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane.
What is the SMILES notation for (8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane?
The canonical SMILES for (8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane is CC1C2C=CC=CC2C2C1c1cc(C(C)(C)C)ccc1N2C[Si](C)(C)C.
What is the InChIKey of (8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane?
The InChIKey is YEJFPFXMJUFXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H35NSi/c1-16-18-10-8-9-11-19(18)23-22(16)20-14-17(24(2,3)4)12-13-21(20)25(23)15-26(5,6)7/h8-14,16,18-19,22-23H,15H2,1-7H3.
What are the key properties of (8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane?
(8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane has a molecular weight of 365.64 g/mol, XLogP of 6.14, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (8-tert-butyl-10-methyl-4b,9b,10,10a-tetrahydro-4aH-indeno[1,2-b]indol-5-yl)methyl-trimethylsilane is sourced from PubChem (CID 140802078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).