trimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane

C13H24N2Si — CID 90856889

IUPACtrimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane
SMILESCN1CCC[C@H]1C1=CN=CCC1[Si](C)(C)C
InChIInChI=1S/C13H24N2Si/c1-15-9-5-6-12(15)11-10-14-8-7-13(11)16(2,3)4/h8,10,12-13H,5-7,9H2,1-4H3/t12-,13?/m0/s1
InChIKeyIBCXQKKRMGMMKG-UEWDXFNNSA-N
MW236.43 g/mol
LogP3.15
Rot. Bonds2

About trimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane

trimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane (PubChem CID 90856889) has the molecular formula C13H24N2Si and a molecular weight of 236.43 g/mol. Its IUPAC name is trimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane.

Molecular Properties

Compound Nametrimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane
PubChem CID90856889
Molecular FormulaC13H24N2Si
Molecular Weight236.43 g/mol
Exact Mass236.17
IUPAC Nametrimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane
SMILESCN1CCC[C@H]1C1=CN=CCC1[Si](C)(C)C
InChIInChI=1S/C13H24N2Si/c1-15-9-5-6-12(15)11-10-14-8-7-13(11)16(2,3)4/h8,10,12-13H,5-7,9H2,1-4H3/t12-,13?/m0/s1
InChIKeyIBCXQKKRMGMMKG-UEWDXFNNSA-N
XLogP3.15
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.43
LogP ≤ 53.15
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 trimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane?
The IUPAC name of trimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane (CID 90856889) is trimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane.
What is the SMILES notation for trimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane?
The canonical SMILES for trimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane is CN1CCC[C@H]1C1=CN=CCC1[Si](C)(C)C.
What is the InChIKey of trimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane?
The InChIKey is IBCXQKKRMGMMKG-UEWDXFNNSA-N. The full InChI is InChI=1S/C13H24N2Si/c1-15-9-5-6-12(15)11-10-14-8-7-13(11)16(2,3)4/h8,10,12-13H,5-7,9H2,1-4H3/t12-,13?/m0/s1.
What are the key properties of trimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane?
trimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane has a molecular weight of 236.43 g/mol, XLogP of 3.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[5-[(2S)-1-methylpyrrolidin-2-yl]-3,4-dihydropyridin-4-yl]silane is sourced from PubChem (CID 90856889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).