4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane

C19H28N2Si — CID 58634160

IUPAC4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane
SMILESC[C@H]1NCCN1[Si](C)(C)C1C2C=CC=CC2C2C=CC=CC21
InChIInChI=1S/C19H28N2Si/c1-14-20-12-13-21(14)22(2,3)19-17-10-6-4-8-15(17)16-9-5-7-11-18(16)19/h4-11,14-20H,12-13H2,1-3H3/t14-,15?,16?,17?,18?,19?/m0/s1
InChIKeySSNOSDLUSSGSES-QWEMWOLJSA-N
MW312.53 g/mol
LogP3.54
Rot. Bonds2

About 4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane

4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane (PubChem CID 58634160) has the molecular formula C19H28N2Si and a molecular weight of 312.53 g/mol. Its IUPAC name is 4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane.

Molecular Properties

Compound Name4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane
PubChem CID58634160
Molecular FormulaC19H28N2Si
Molecular Weight312.53 g/mol
Exact Mass312.20
IUPAC Name4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane
SMILESC[C@H]1NCCN1[Si](C)(C)C1C2C=CC=CC2C2C=CC=CC21
InChIInChI=1S/C19H28N2Si/c1-14-20-12-13-21(14)22(2,3)19-17-10-6-4-8-15(17)16-9-5-7-11-18(16)19/h4-11,14-20H,12-13H2,1-3H3/t14-,15?,16?,17?,18?,19?/m0/s1
InChIKeySSNOSDLUSSGSES-QWEMWOLJSA-N
XLogP3.54
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.53
LogP ≤ 53.54
H-Bond Donors ≤ 51
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 4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane?
The IUPAC name of 4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane (CID 58634160) is 4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane.
What is the SMILES notation for 4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane?
The canonical SMILES for 4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane is C[C@H]1NCCN1[Si](C)(C)C1C2C=CC=CC2C2C=CC=CC21.
What is the InChIKey of 4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane?
The InChIKey is SSNOSDLUSSGSES-QWEMWOLJSA-N. The full InChI is InChI=1S/C19H28N2Si/c1-14-20-12-13-21(14)22(2,3)19-17-10-6-4-8-15(17)16-9-5-7-11-18(16)19/h4-11,14-20H,12-13H2,1-3H3/t14-,15?,16?,17?,18?,19?/m0/s1.
What are the key properties of 4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane?
4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane has a molecular weight of 312.53 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4b,8a,9,9a-tetrahydro-4aH-fluoren-9-yl-dimethyl-[(2S)-2-methylimidazolidin-1-yl]silane is sourced from PubChem (CID 58634160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).