N-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine

C19H29NSi — CID 101138340

IUPACN-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine
SMILESC=CCCC1=CC([Si](C)(C)NC(C)(C)C)c2ccccc21
InChIInChI=1S/C19H29NSi/c1-7-8-11-15-14-18(17-13-10-9-12-16(15)17)21(5,6)20-19(2,3)4/h7,9-10,12-14,18,20H,1,8,11H2,2-6H3
InChIKeyPUOQRUQBZSLLBG-UHFFFAOYSA-N
MW299.53 g/mol
LogP5.27
Rot. Bonds5

About N-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine

N-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine (PubChem CID 101138340) has the molecular formula C19H29NSi and a molecular weight of 299.53 g/mol. Its IUPAC name is N-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine
PubChem CID101138340
Molecular FormulaC19H29NSi
Molecular Weight299.53 g/mol
Exact Mass299.21
IUPAC NameN-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine
SMILESC=CCCC1=CC([Si](C)(C)NC(C)(C)C)c2ccccc21
InChIInChI=1S/C19H29NSi/c1-7-8-11-15-14-18(17-13-10-9-12-16(15)17)21(5,6)20-19(2,3)4/h7,9-10,12-14,18,20H,1,8,11H2,2-6H3
InChIKeyPUOQRUQBZSLLBG-UHFFFAOYSA-N
XLogP5.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.53
LogP ≤ 55.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Launch Full Analysis

Related Compounds

N-[[3-[[3-[(tert-butylamino)-dimethylsilyl]-3H-inden-1-yl]methyl]-1H-inden-1-yl]-dimethylsilyl]-2-methylpropan-2-amine
CID 101352124
N-[dimethyl-[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]silyl]-2-methylpropan-2-amine
CID 140733141
N-[[3-[5-[3-[(tert-butylamino)-dimethylsilyl]-3H-inden-1-yl]nonyl]-1H-inden-1-yl]-dimethylsilyl]-2-methylpropan-2-amine
CID 142652299
(3-ethyl-1H-inden-1-yl)-trimethylsilane
CID 135047164
N-[(2,3-dimethyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine
CID 19366088
hex-5-enyl-[(1R)-3-[hex-5-enyl(dimethyl)silyl]-1H-inden-1-yl]-dimethylsilane
CID 101408626
N-[dimethyl-(2-methyl-1H-inden-1-yl)silyl]-2-methylpropan-2-amine;(2E,4E)-hexa-2,4-diene
CID 140997986
dimethyl-(3-propyl-1H-inden-1-yl)-(2,3,4-trimethylcyclopenta-2,4-dien-1-yl)silane
CID 153307789
N-[dimethyl-(2-trimethylsilyl-1H-inden-1-yl)silyl]-2-methylpropan-2-amine
CID 101443587
1,1-dichlorohex-5-enyl-bis(9H-fluoren-9-yl)-methylsilane
CID 140967319
N-[dimethyl-(2-methyl-1H-inden-1-yl)silyl]-2-methylpropan-2-amine;[(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
CID 141005417
(3-tert-butyl-1H-inden-1-yl)-trimethylsilane
CID 134888721

Frequently Asked Questions

What is the IUPAC name of N-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine?
The IUPAC name of N-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine (CID 101138340) is N-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine is C=CCCC1=CC([Si](C)(C)NC(C)(C)C)c2ccccc21.
What is the InChIKey of N-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine?
The InChIKey is PUOQRUQBZSLLBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NSi/c1-7-8-11-15-14-18(17-13-10-9-12-16(15)17)21(5,6)20-19(2,3)4/h7,9-10,12-14,18,20H,1,8,11H2,2-6H3.
What are the key properties of N-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine?
N-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine has a molecular weight of 299.53 g/mol, XLogP of 5.27, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-but-3-enyl-1H-inden-1-yl)-dimethylsilyl]-2-methylpropan-2-amine is sourced from PubChem (CID 101138340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).