(5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol

C22H36OSi — CID 10427633

IUPAC(5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol
SMILESC=CCCCCC=C=C[C@@H](O)[C@](C#CC)(CCC(=C)C)[Si](C)(C)C
InChIInChI=1S/C22H36OSi/c1-8-10-11-12-13-14-15-16-21(23)22(18-9-2,24(5,6)7)19-17-20(3)4/h8,14,16,21,23H,1,3,10-13,17,19H2,2,4-7H3/t15?,21-,22+/m1/s1
InChIKeyKJIFSTZZNIIUGG-LQJNRQTASA-N
MW344.62 g/mol
LogP6.26
Rot. Bonds11

About (5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol

(5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol (PubChem CID 10427633) has the molecular formula C22H36OSi and a molecular weight of 344.62 g/mol. Its IUPAC name is (5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol.

Molecular Properties

Compound Name(5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol
PubChem CID10427633
Molecular FormulaC22H36OSi
Molecular Weight344.62 g/mol
Exact Mass344.25
IUPAC Name(5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol
SMILESC=CCCCCC=C=C[C@@H](O)[C@](C#CC)(CCC(=C)C)[Si](C)(C)C
InChIInChI=1S/C22H36OSi/c1-8-10-11-12-13-14-15-16-21(23)22(18-9-2,24(5,6)7)19-17-20(3)4/h8,14,16,21,23H,1,3,10-13,17,19H2,2,4-7H3/t15?,21-,22+/m1/s1
InChIKeyKJIFSTZZNIIUGG-LQJNRQTASA-N
XLogP6.26
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.62
LogP ≤ 56.26
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze (5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol 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

(4R,5R)-8-butyl-4-methyl-4-trimethylsilyldodeca-6,7-dien-2-yn-5-ol
CID 15721121
(5R,6R)-2-methyl-6-prop-1-ynyl-6-trimethylsilyldeca-2,3,9-trien-5-ol
CID 15721123
(6R,7R)-6-prop-1-ynyl-6-trimethylsilylhexadeca-1,8,9,15-tetraen-7-ol
CID 15778100
(6R,7R)-3,3-dimethyl-6-prop-1-ynyl-6-trimethylsilylhexadeca-1,8,9,15-tetraen-7-ol
CID 134978481
(5R,6R)-2,9,9-trimethyl-6-prop-1-ynyl-6-trimethylsilylundeca-2,3,10-trien-5-ol
CID 134978482
6-Methylidene-10-trimethylsilyldec-1-en-9-yn-3-ol
CID 139252744
6-Methylidene-10-trimethylsilyldec-1-en-9-yn-5-ol
CID 139252751
5-Methylidene-1-trimethylsilyldec-9-en-1-yn-4-ol
CID 139252754
(4E)-4-(trimethylsilylmethylidene)tetradec-1-en-3-ol
CID 15013192
11-Methyl-7-methylidene-1-tributylstannyl-10-triethylsilyloxytetradec-8-yn-6-ol
CID 88777727
11-[Tert-butyl(dimethyl)silyl]oxy-3-methyl-6-prop-1-en-2-ylundeca-1,2-dien-9-yn-4-ol
CID 10427863
(5R,6R)-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol
CID 10449336

Frequently Asked Questions

What is the IUPAC name of (5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol?
The IUPAC name of (5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol (CID 10427633) is (5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol.
What is the SMILES notation for (5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol?
The canonical SMILES for (5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol is C=CCCCCC=C=C[C@@H](O)[C@](C#CC)(CCC(=C)C)[Si](C)(C)C.
What is the InChIKey of (5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol?
The InChIKey is KJIFSTZZNIIUGG-LQJNRQTASA-N. The full InChI is InChI=1S/C22H36OSi/c1-8-10-11-12-13-14-15-16-21(23)22(18-9-2,24(5,6)7)19-17-20(3)4/h8,14,16,21,23H,1,3,10-13,17,19H2,2,4-7H3/t15?,21-,22+/m1/s1.
What are the key properties of (5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol?
(5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol has a molecular weight of 344.62 g/mol, XLogP of 6.26, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R,6R)-2-methyl-5-prop-1-ynyl-5-trimethylsilylpentadeca-1,7,8,14-tetraen-6-ol is sourced from PubChem (CID 10427633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).