dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane

C30H30N2Si — CID 68772600

IUPACdimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane
SMILESCC1=Cc2c(cccc2-n2cccc2)[C@@H]1[Si](C)(C)[C@H]1C(C)=Cc2c1cccc2-n1cccc1
InChIInChI=1S/C30H30N2Si/c1-21-19-25-23(11-9-13-27(25)31-15-5-6-16-31)29(21)33(3,4)30-22(2)20-26-24(30)12-10-14-28(26)32-17-7-8-18-32/h5-20,29-30H,1-4H3/t29-,30+
InChIKeyJTAZQGSNJKRBJX-RNPORBBMSA-N
MW446.67 g/mol
LogP7.76
Rot. Bonds4

About dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane

dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane (PubChem CID 68772600) has the molecular formula C30H30N2Si and a molecular weight of 446.67 g/mol. Its IUPAC name is dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane.

Molecular Properties

Compound Namedimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane
PubChem CID68772600
Molecular FormulaC30H30N2Si
Molecular Weight446.67 g/mol
Exact Mass446.22
IUPAC Namedimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane
SMILESCC1=Cc2c(cccc2-n2cccc2)[C@@H]1[Si](C)(C)[C@H]1C(C)=Cc2c1cccc2-n1cccc1
InChIInChI=1S/C30H30N2Si/c1-21-19-25-23(11-9-13-27(25)31-15-5-6-16-31)29(21)33(3,4)30-22(2)20-26-24(30)12-10-14-28(26)32-17-7-8-18-32/h5-20,29-30H,1-4H3/t29-,30+
InChIKeyJTAZQGSNJKRBJX-RNPORBBMSA-N
XLogP7.76
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.67
LogP ≤ 57.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane?
The IUPAC name of dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane (CID 68772600) is dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane.
What is the SMILES notation for dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane?
The canonical SMILES for dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane is CC1=Cc2c(cccc2-n2cccc2)[C@@H]1[Si](C)(C)[C@H]1C(C)=Cc2c1cccc2-n1cccc1.
What is the InChIKey of dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane?
The InChIKey is JTAZQGSNJKRBJX-RNPORBBMSA-N. The full InChI is InChI=1S/C30H30N2Si/c1-21-19-25-23(11-9-13-27(25)31-15-5-6-16-31)29(21)33(3,4)30-22(2)20-26-24(30)12-10-14-28(26)32-17-7-8-18-32/h5-20,29-30H,1-4H3/t29-,30+.
What are the key properties of dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane?
dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane has a molecular weight of 446.67 g/mol, XLogP of 7.76, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[(1R)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]-[(1S)-2-methyl-4-pyrrol-1-yl-1H-inden-1-yl]silane is sourced from PubChem (CID 68772600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).