tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+))

C143H214N12OSc4Si4 — CID 162279528

IUPACtert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+))
SMILESCC(C)(C)[N-]C[Si](C)(C)C1CC(N2CCCC2)C2C=CC=CC21.CC(C)(C)[N-][Si](C)(C)CC1CC(N2CCCC2)C2C=CC=CC12.CC1=CC2C(C=C1)C([Si]([N-]C(C)(C)C)(c1ccccc1)c1ccccc1)CC2N1CCCC1.COC1=CC2C(C=C1C)C([Si]([N-]C(C)(C)C)(c1ccc(C)cc1)c1ccc(C)cc1)CC2N1CCCC1.[CH2-]c1ccccc1N(C)C.[CH2-]c1ccccc1N(C)C.[CH2-]c1ccccc1N(C)C.[CH2-]c1ccccc1N(C)C.[CH3-].[CH3-].[CH3-].[CH3-].[Sc+3].[Sc+3].[Sc+3].[Sc+3]
InChIInChI=1S/C33H45N2OSi.C30H39N2Si.2C20H35N2Si.4C9H12N.4CH3.4Sc/c1-23-10-14-26(15-11-23)37(34-33(4,5)6,27-16-12-24(2)13-17-27)32-22-30(35-18-8-9-19-35)28-21-31(36-7)25(3)20-29(28)32;1-23-17-18-26-27(21-23)28(32-19-11-12-20-32)22-29(26)33(31-30(2,3)4,24-13-7-5-8-14-24)25-15-9-6-10-16-25;1-20(2,3)21-23(4,5)15-16-14-19(22-12-8-9-13-22)18-11-7-6-10-17(16)18;1-20(2,3)21-15-23(4,5)19-14-18(22-12-8-9-13-22)16-10-6-7-11-17(16)19;4*1-8-6-4-5-7-9(8)10(2)3;;;;;;;;/h10-17,20-21,28-30,32H,8-9,18-19,22H2,1-7H3;5-10,13-18,21,26-29H,11-12,19-20,22H2,1-4H3;2*6-7,10-11,16-19H,8-9,12-15H2,1-5H3;4*4-7H,1H2,2-3H3;4*1H3;;;;/q12*-1;4*+3
InChIKeyXKZQBCXRQIHAED-UHFFFAOYSA-N
MW2409.54 g/mol
LogP32.14
Rot. Bonds23

About tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+))

tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+)) (PubChem CID 162279528) has the molecular formula C143H214N12OSc4Si4 and a molecular weight of 2409.54 g/mol. Its IUPAC name is tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+)).

Molecular Properties

Compound Nametert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+))
PubChem CID162279528
Molecular FormulaC143H214N12OSc4Si4
Molecular Weight2409.54 g/mol
Exact Mass2407.44
IUPAC Nametert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+))
SMILESCC(C)(C)[N-]C[Si](C)(C)C1CC(N2CCCC2)C2C=CC=CC21.CC(C)(C)[N-][Si](C)(C)CC1CC(N2CCCC2)C2C=CC=CC12.CC1=CC2C(C=C1)C([Si]([N-]C(C)(C)C)(c1ccccc1)c1ccccc1)CC2N1CCCC1.COC1=CC2C(C=C1C)C([Si]([N-]C(C)(C)C)(c1ccc(C)cc1)c1ccc(C)cc1)CC2N1CCCC1.[CH2-]c1ccccc1N(C)C.[CH2-]c1ccccc1N(C)C.[CH2-]c1ccccc1N(C)C.[CH2-]c1ccccc1N(C)C.[CH3-].[CH3-].[CH3-].[CH3-].[Sc+3].[Sc+3].[Sc+3].[Sc+3]
InChIInChI=1S/C33H45N2OSi.C30H39N2Si.2C20H35N2Si.4C9H12N.4CH3.4Sc/c1-23-10-14-26(15-11-23)37(34-33(4,5)6,27-16-12-24(2)13-17-27)32-22-30(35-18-8-9-19-35)28-21-31(36-7)25(3)20-29(28)32;1-23-17-18-26-27(21-23)28(32-19-11-12-20-32)22-29(26)33(31-30(2,3)4,24-13-7-5-8-14-24)25-15-9-6-10-16-25;1-20(2,3)21-23(4,5)15-16-14-19(22-12-8-9-13-22)18-11-7-6-10-17(16)18;1-20(2,3)21-15-23(4,5)19-14-18(22-12-8-9-13-22)16-10-6-7-11-17(16)19;4*1-8-6-4-5-7-9(8)10(2)3;;;;;;;;/h10-17,20-21,28-30,32H,8-9,18-19,22H2,1-7H3;5-10,13-18,21,26-29H,11-12,19-20,22H2,1-4H3;2*6-7,10-11,16-19H,8-9,12-15H2,1-5H3;4*4-7H,1H2,2-3H3;4*1H3;;;;/q12*-1;4*+3
InChIKeyXKZQBCXRQIHAED-UHFFFAOYSA-N
XLogP32.14
TPSA91.55 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds23
Heavy Atoms164
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002409.54
LogP ≤ 532.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+)) 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 tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+))?
The IUPAC name of tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+)) (CID 162279528) is tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+)).
What is the SMILES notation for tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+))?
The canonical SMILES for tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+)) is CC(C)(C)[N-]C[Si](C)(C)C1CC(N2CCCC2)C2C=CC=CC21.CC(C)(C)[N-][Si](C)(C)CC1CC(N2CCCC2)C2C=CC=CC12.CC1=CC2C(C=C1)C([Si]([N-]C(C)(C)C)(c1ccccc1)c1ccccc1)CC2N1CCCC1.COC1=CC2C(C=C1C)C([Si]([N-]C(C)(C)C)(c1ccc(C)cc1)c1ccc(C)cc1)CC2N1CCCC1.[CH2-]c1ccccc1N(C)C.[CH2-]c1ccccc1N(C)C.[CH2-]c1ccccc1N(C)C.[CH2-]c1ccccc1N(C)C.[CH3-].[CH3-].[CH3-].[CH3-].[Sc+3].[Sc+3].[Sc+3].[Sc+3].
What is the InChIKey of tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+))?
The InChIKey is XKZQBCXRQIHAED-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H45N2OSi.C30H39N2Si.2C20H35N2Si.4C9H12N.4CH3.4Sc/c1-23-10-14-26(15-11-23)37(34-33(4,5)6,27-16-12-24(2)13-17-27)32-22-30(35-18-8-9-19-35)28-21-31(36-7)25(3)20-29(28)32;1-23-17-18-26-27(21-23)28(32-19-11-12-20-32)22-29(26)33(31-30(2,3)4,24-13-7-5-8-14-24)25-15-9-6-10-16-25;1-20(2,3)21-23(4,5)15-16-14-19(22-12-8-9-13-22)18-11-7-6-10-17(16)18;1-20(2,3)21-15-23(4,5)19-14-18(22-12-8-9-13-22)16-10-6-7-11-17(16)19;4*1-8-6-4-5-7-9(8)10(2)3;;;;;;;;/h10-17,20-21,28-30,32H,8-9,18-19,22H2,1-7H3;5-10,13-18,21,26-29H,11-12,19-20,22H2,1-4H3;2*6-7,10-11,16-19H,8-9,12-15H2,1-5H3;4*4-7H,1H2,2-3H3;4*1H3;;;;/q12*-1;4*+3.
What are the key properties of tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+))?
tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+)) has a molecular weight of 2409.54 g/mol, XLogP of 32.14, 23 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[dimethyl-[(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)methyl]silyl]azanide;tert-butyl-[[dimethyl-(3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silyl]methyl]azanide;tert-butyl-[(5-methoxy-6-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-bis(4-methylphenyl)silyl]azanide;tert-butyl-[(5-methyl-3-pyrrolidin-1-yl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-diphenylsilyl]azanide;carbanide;tetrakis(2-methanidyl-N,N-dimethylaniline);tetrakis(scandium(3+)) is sourced from PubChem (CID 162279528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).