(2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine

C18H31NSi — CID 174108529

IUPAC(2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine
SMILES[H]/N=C/C(C)=C/C(=C)C(C)(C)/C(C)=C/C(=C\C)[Si](C)(C)C
InChIInChI=1S/C18H31NSi/c1-10-17(20(7,8)9)12-16(4)18(5,6)15(3)11-14(2)13-19/h10-13,19H,3H2,1-2,4-9H3/b14-11+,16-12+,17-10+,19-13+
InChIKeyHEJFQYCARLYOSN-YPLVXHNCSA-N
MW289.54 g/mol
LogP5.93
Rot. Bonds6

About (2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine

(2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine (PubChem CID 174108529) has the molecular formula C18H31NSi and a molecular weight of 289.54 g/mol. Its IUPAC name is (2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine.

Molecular Properties

Compound Name(2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine
PubChem CID174108529
Molecular FormulaC18H31NSi
Molecular Weight289.54 g/mol
Exact Mass289.22
IUPAC Name(2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine
SMILES[H]/N=C/C(C)=C/C(=C)C(C)(C)/C(C)=C/C(=C\C)[Si](C)(C)C
InChIInChI=1S/C18H31NSi/c1-10-17(20(7,8)9)12-16(4)18(5,6)15(3)11-14(2)13-19/h10-13,19H,3H2,1-2,4-9H3/b14-11+,16-12+,17-10+,19-13+
InChIKeyHEJFQYCARLYOSN-YPLVXHNCSA-N
XLogP5.93
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500289.54
LogP ≤ 55.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

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[(Z)-3-imino-2-methylprop-1-enyl]-methylazanium
CID 145336360
3-[1-[(2E,4E)-4-tert-butylhexa-2,4-dien-2-yl]cyclopentyl]-2-methylidenebut-3-en-1-imine
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(Z)-N',2-dimethylbut-2-ene-1,4-diimine
CID 167038959
2-ethylidene-3-methylpent-3-en-1-imine
CID 123743137
(2Z,4Z)-4-(4-fluoro-1-oxothian-4-yl)-2-methylhexa-2,4-dien-1-imine
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Frequently Asked Questions

What is the IUPAC name of (2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine?
The IUPAC name of (2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine (CID 174108529) is (2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine.
What is the SMILES notation for (2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine?
The canonical SMILES for (2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine is [H]/N=C/C(C)=C/C(=C)C(C)(C)/C(C)=C/C(=C\C)[Si](C)(C)C.
What is the InChIKey of (2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine?
The InChIKey is HEJFQYCARLYOSN-YPLVXHNCSA-N. The full InChI is InChI=1S/C18H31NSi/c1-10-17(20(7,8)9)12-16(4)18(5,6)15(3)11-14(2)13-19/h10-13,19H,3H2,1-2,4-9H3/b14-11+,16-12+,17-10+,19-13+.
What are the key properties of (2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine?
(2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine has a molecular weight of 289.54 g/mol, XLogP of 5.93, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,6E,8E)-2,5,5,6-tetramethyl-4-methylidene-8-trimethylsilyldeca-2,6,8-trien-1-imine is sourced from PubChem (CID 174108529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).