chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane

C19H28ClNSi — CID 172552334

IUPACchloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane
SMILESCC(C)[Si](Cl)(C(C)C)C1C=C(N2CCCC2)c2ccccc21
InChIInChI=1S/C19H28ClNSi/c1-14(2)22(20,15(3)4)19-13-18(21-11-7-8-12-21)16-9-5-6-10-17(16)19/h5-6,9-10,13-15,19H,7-8,11-12H2,1-4H3
InChIKeySIDUJYDOYAAPME-UHFFFAOYSA-N
MW333.98 g/mol
LogP5.76
Rot. Bonds4

About chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane

chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane (PubChem CID 172552334) has the molecular formula C19H28ClNSi and a molecular weight of 333.98 g/mol. Its IUPAC name is chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane.

Molecular Properties

Compound Namechloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane
PubChem CID172552334
Molecular FormulaC19H28ClNSi
Molecular Weight333.98 g/mol
Exact Mass333.17
IUPAC Namechloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane
SMILESCC(C)[Si](Cl)(C(C)C)C1C=C(N2CCCC2)c2ccccc21
InChIInChI=1S/C19H28ClNSi/c1-14(2)22(20,15(3)4)19-13-18(21-11-7-8-12-21)16-9-5-6-10-17(16)19/h5-6,9-10,13-15,19H,7-8,11-12H2,1-4H3
InChIKeySIDUJYDOYAAPME-UHFFFAOYSA-N
XLogP5.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.98
LogP ≤ 55.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane?
The IUPAC name of chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane (CID 172552334) is chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane.
What is the SMILES notation for chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane?
The canonical SMILES for chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane is CC(C)[Si](Cl)(C(C)C)C1C=C(N2CCCC2)c2ccccc21.
What is the InChIKey of chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane?
The InChIKey is SIDUJYDOYAAPME-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28ClNSi/c1-14(2)22(20,15(3)4)19-13-18(21-11-7-8-12-21)16-9-5-6-10-17(16)19/h5-6,9-10,13-15,19H,7-8,11-12H2,1-4H3.
What are the key properties of chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane?
chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane has a molecular weight of 333.98 g/mol, XLogP of 5.76, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-di(propan-2-yl)-(3-pyrrolidin-1-yl-1H-inden-1-yl)silane is sourced from PubChem (CID 172552334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).