hept-2-ynyl(trimethyl)silane

C10H20Si — CID 12814257

IUPAChept-2-ynyl(trimethyl)silane
SMILESCCCCC#CC[Si](C)(C)C
InChIInChI=1S/C10H20Si/c1-5-6-7-8-9-10-11(2,3)4/h5-7,10H2,1-4H3
InChIKeyGOTBDQFLYWKKOL-UHFFFAOYSA-N
MW168.36 g/mol
LogP3.52
Rot. Bonds3

About hept-2-ynyl(trimethyl)silane

hept-2-ynyl(trimethyl)silane (PubChem CID 12814257) has the molecular formula C10H20Si and a molecular weight of 168.36 g/mol. Its IUPAC name is hept-2-ynyl(trimethyl)silane.

Molecular Properties

Compound Namehept-2-ynyl(trimethyl)silane
PubChem CID12814257
Molecular FormulaC10H20Si
Molecular Weight168.36 g/mol
Exact Mass168.13
IUPAC Namehept-2-ynyl(trimethyl)silane
SMILESCCCCC#CC[Si](C)(C)C
InChIInChI=1S/C10H20Si/c1-5-6-7-8-9-10-11(2,3)4/h5-7,10H2,1-4H3
InChIKeyGOTBDQFLYWKKOL-UHFFFAOYSA-N
XLogP3.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.36
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze hept-2-ynyl(trimethyl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Butynyltrimethylsilane
CID 43926
3,3-Dimethyl-1-trimethylsilyl-1-butyne
CID 139797
1-(Trimethylsilyl)-1-hexyne
CID 586959
1-(Trimethylsilyl)-1-pentyne
CID 2760860
1-(Triisopropylsilyl)-1-propyne
CID 4074566
1,3-Bis(trimethylsilyl)propyne
CID 140859
Trimethyl(pentyl)silane
CID 267518
1-Trimethylsilyl-1,4-pentadiyne
CID 144510
1,4-Bis(trimethylsilyl)-2-butyne
CID 140858
Silane, 1,5-hexadiyne-1,6-diylbis[trimethyl-
CID 10867902
Trimethyl-octa-1,7-diynyl-silane
CID 11275361
Silane, 1,3-decadiynyltrimethyl-
CID 605581

Frequently Asked Questions

What is the IUPAC name of hept-2-ynyl(trimethyl)silane?
The IUPAC name of hept-2-ynyl(trimethyl)silane (CID 12814257) is hept-2-ynyl(trimethyl)silane.
What is the SMILES notation for hept-2-ynyl(trimethyl)silane?
The canonical SMILES for hept-2-ynyl(trimethyl)silane is CCCCC#CC[Si](C)(C)C.
What is the InChIKey of hept-2-ynyl(trimethyl)silane?
The InChIKey is GOTBDQFLYWKKOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20Si/c1-5-6-7-8-9-10-11(2,3)4/h5-7,10H2,1-4H3.
What are the key properties of hept-2-ynyl(trimethyl)silane?
hept-2-ynyl(trimethyl)silane has a molecular weight of 168.36 g/mol, XLogP of 3.52, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hept-2-ynyl(trimethyl)silane is sourced from PubChem (CID 12814257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).