N-silyloctadeca-9,12,15-trienamide

C18H33NOSi — CID 123430456

IUPACN-silyloctadeca-9,12,15-trienamide
SMILESCCC=CCC=CCC=CCCCCCCCC(=O)N[SiH3]
InChIInChI=1S/C18H33NOSi/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19-21/h3-4,6-7,9-10H,2,5,8,11-17H2,1,21H3,(H,19,20)
InChIKeyYOIRKMJXFDSNQL-UHFFFAOYSA-N
MW307.55 g/mol
LogP3.97
Rot. Bonds13

About N-silyloctadeca-9,12,15-trienamide

N-silyloctadeca-9,12,15-trienamide (PubChem CID 123430456) has the molecular formula C18H33NOSi and a molecular weight of 307.55 g/mol. Its IUPAC name is N-silyloctadeca-9,12,15-trienamide.

Molecular Properties

Compound NameN-silyloctadeca-9,12,15-trienamide
PubChem CID123430456
Molecular FormulaC18H33NOSi
Molecular Weight307.55 g/mol
Exact Mass307.23
IUPAC NameN-silyloctadeca-9,12,15-trienamide
SMILESCCC=CCC=CCC=CCCCCCCCC(=O)N[SiH3]
InChIInChI=1S/C18H33NOSi/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19-21/h3-4,6-7,9-10H,2,5,8,11-17H2,1,21H3,(H,19,20)
InChIKeyYOIRKMJXFDSNQL-UHFFFAOYSA-N
XLogP3.97
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.55
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-ethenyloctadeca-9,12,15-trienamide
CID 90956698
CID 87067082
CID 87067082
henicosa-15,18-dienoic acid
CID 169277369
icosa-8,14,17-trienoic acid
CID 54189424
octacosa-10,13,16,19,22,25-hexaenoic acid
CID 75955160
(19Z,22Z,25Z,28Z,31Z)-tetratriaconta-19,22,25,28,31-pentaenoic acid
CID 14753668
(12Z,15Z)-octadeca-12,15-dienoic acid
CID 5312453
(10Z,13Z,16Z,19Z,22Z,25Z)-octacosa-10,13,16,19,22,25-hexaenoic acid
CID 52921814
(8Z,11Z,14Z,17Z,20Z,23Z,26Z,29Z)-dotriaconta-8,11,14,17,20,23,26,29-octaenoic acid
CID 165203838
(9Z,12Z,15Z,18Z)-tetracosa-9,12,15,18,21-pentaenoic acid
CID 87220855
methyl (13Z,16E,19E)-docosa-13,16,19-trienoate
CID 53249236
methyl (10E,13E,16E,19E)-docosa-10,13,16,19-tetraenoate
CID 10472831

Frequently Asked Questions

What is the IUPAC name of N-silyloctadeca-9,12,15-trienamide?
The IUPAC name of N-silyloctadeca-9,12,15-trienamide (CID 123430456) is N-silyloctadeca-9,12,15-trienamide.
What is the SMILES notation for N-silyloctadeca-9,12,15-trienamide?
The canonical SMILES for N-silyloctadeca-9,12,15-trienamide is CCC=CCC=CCC=CCCCCCCCC(=O)N[SiH3].
What is the InChIKey of N-silyloctadeca-9,12,15-trienamide?
The InChIKey is YOIRKMJXFDSNQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33NOSi/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19-21/h3-4,6-7,9-10H,2,5,8,11-17H2,1,21H3,(H,19,20).
What are the key properties of N-silyloctadeca-9,12,15-trienamide?
N-silyloctadeca-9,12,15-trienamide has a molecular weight of 307.55 g/mol, XLogP of 3.97, 13 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-silyloctadeca-9,12,15-trienamide is sourced from PubChem (CID 123430456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).