N-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine

C24H27NSi — CID 172846629

IUPACN-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine
SMILESC[SiH](C)CC(C)(C)NC1=CC(c2ccccc2)=c2cc3c(cc21)=CC=C3
InChIInChI=1S/C24H27NSi/c1-24(2,16-26(3)4)25-23-15-20(17-9-6-5-7-10-17)21-13-18-11-8-12-19(18)14-22(21)23/h5-15,25-26H,16H2,1-4H3
InChIKeyXMXKZBGKBYSKDY-UHFFFAOYSA-N
MW357.57 g/mol
LogP3.90
Rot. Bonds5

About N-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine

N-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine (PubChem CID 172846629) has the molecular formula C24H27NSi and a molecular weight of 357.57 g/mol. Its IUPAC name is N-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine.

Molecular Properties

Compound NameN-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine
PubChem CID172846629
Molecular FormulaC24H27NSi
Molecular Weight357.57 g/mol
Exact Mass357.19
IUPAC NameN-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine
SMILESC[SiH](C)CC(C)(C)NC1=CC(c2ccccc2)=c2cc3c(cc21)=CC=C3
InChIInChI=1S/C24H27NSi/c1-24(2,16-26(3)4)25-23-15-20(17-9-6-5-7-10-17)21-13-18-11-8-12-19(18)14-22(21)23/h5-15,25-26H,16H2,1-4H3
InChIKeyXMXKZBGKBYSKDY-UHFFFAOYSA-N
XLogP3.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.57
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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pentacyclo[10.8.0.02,9.04,8.013,19]icosa-1(20),2(9),3,5,7,10,12,14,16,18-decaene
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Frequently Asked Questions

What is the IUPAC name of N-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine?
The IUPAC name of N-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine (CID 172846629) is N-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine.
What is the SMILES notation for N-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine?
The canonical SMILES for N-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine is C[SiH](C)CC(C)(C)NC1=CC(c2ccccc2)=c2cc3c(cc21)=CC=C3.
What is the InChIKey of N-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine?
The InChIKey is XMXKZBGKBYSKDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27NSi/c1-24(2,16-26(3)4)25-23-15-20(17-9-6-5-7-10-17)21-13-18-11-8-12-19(18)14-22(21)23/h5-15,25-26H,16H2,1-4H3.
What are the key properties of N-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine?
N-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine has a molecular weight of 357.57 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-dimethylsilyl-2-methylpropan-2-yl)-3-phenyl-s-indacen-1-amine is sourced from PubChem (CID 172846629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).