dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride

C17H32Li2Si — CID 174397968

IUPACdilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride
SMILESCC1CCC(C(C)C)C(C2=CC([SiH](C)C)C=C2)C1.[H-].[H-].[Li+].[Li+]
InChIInChI=1S/C17H30Si.2Li.2H/c1-12(2)16-9-6-13(3)10-17(16)14-7-8-15(11-14)18(4)5;;;;/h7-8,11-13,15-18H,6,9-10H2,1-5H3;;;;/q;2*+1;2*-1
InChIKeyOTSBXCBWXSDKKS-UHFFFAOYSA-N
MW278.41 g/mol
LogP-0.72
Rot. Bonds3

About dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride

dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride (PubChem CID 174397968) has the molecular formula C17H32Li2Si and a molecular weight of 278.41 g/mol. Its IUPAC name is dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride.

Molecular Properties

Compound Namedilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride
PubChem CID174397968
Molecular FormulaC17H32Li2Si
Molecular Weight278.41 g/mol
Exact Mass278.26
IUPAC Namedilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride
SMILESCC1CCC(C(C)C)C(C2=CC([SiH](C)C)C=C2)C1.[H-].[H-].[Li+].[Li+]
InChIInChI=1S/C17H30Si.2Li.2H/c1-12(2)16-9-6-13(3)10-17(16)14-7-8-15(11-14)18(4)5;;;;/h7-8,11-13,15-18H,6,9-10H2,1-5H3;;;;/q;2*+1;2*-1
InChIKeyOTSBXCBWXSDKKS-UHFFFAOYSA-N
XLogP-0.72
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.41
LogP ≤ 5-0.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride with MolForge

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Related Compounds

(1S,2S,4R)-4-methyl-1-propan-2-yl-2-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)cyclohexane
CID 101104006
4-methyl-2-[5-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-1,4-dien-1-yl]-1-propan-2-ylcyclohexane
CID 88632745
dimethyl-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]silane
CID 124635131
CID 72788762
CID 72788762
CID 134992473
CID 134992473
(2S)-4-methyl-1,2-di(propan-2-yl)cyclohexane
CID 169042978
CID 10962980
CID 10962980
2-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]quinoline
CID 122214686
4-methyl-1-propan-2-yl-2-[2,3,4,5-tetrakis(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-1,4-dien-1-yl]cyclohexane
CID 154422769
CID 66630118
CID 66630118
hypochlorous acid;5-methyl-2-propan-2-ylcyclohexan-1-ol
CID 174568794
(1S,2R,4R)-4-methyl-2-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-1-propan-2-ylcyclohexane
CID 142760387

Frequently Asked Questions

What is the IUPAC name of dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride?
The IUPAC name of dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride (CID 174397968) is dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride.
What is the SMILES notation for dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride?
The canonical SMILES for dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride is CC1CCC(C(C)C)C(C2=CC([SiH](C)C)C=C2)C1.[H-].[H-].[Li+].[Li+].
What is the InChIKey of dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride?
The InChIKey is OTSBXCBWXSDKKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30Si.2Li.2H/c1-12(2)16-9-6-13(3)10-17(16)14-7-8-15(11-14)18(4)5;;;;/h7-8,11-13,15-18H,6,9-10H2,1-5H3;;;;/q;2*+1;2*-1.
What are the key properties of dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride?
dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride has a molecular weight of 278.41 g/mol, XLogP of -0.72, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;dimethyl-[3-(5-methyl-2-propan-2-ylcyclohexyl)cyclopenta-2,4-dien-1-yl]silane;hydride is sourced from PubChem (CID 174397968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).