(1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol

C24H46OSi — CID 134982741

IUPAC(1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol
SMILESCCCCC/C=C1C(=C/[Si](C)(C)C)/CC[C@H]/1[C@@H](O)CCCCCCCC
InChIInChI=1S/C24H46OSi/c1-6-8-10-12-13-15-17-24(25)23-19-18-21(20-26(3,4)5)22(23)16-14-11-9-7-2/h16,20,23-25H,6-15,17-19H2,1-5H3/b21-20+,22-16-/t23-,24+/m1/s1
InChIKeyYHDPAPINDSIAOL-ODXBVOBVSA-N
MW378.72 g/mol
LogP7.82
Rot. Bonds13

About (1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol

(1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol (PubChem CID 134982741) has the molecular formula C24H46OSi and a molecular weight of 378.72 g/mol. Its IUPAC name is (1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol.

Molecular Properties

Compound Name(1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol
PubChem CID134982741
Molecular FormulaC24H46OSi
Molecular Weight378.72 g/mol
Exact Mass378.33
IUPAC Name(1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol
SMILESCCCCC/C=C1C(=C/[Si](C)(C)C)/CC[C@H]/1[C@@H](O)CCCCCCCC
InChIInChI=1S/C24H46OSi/c1-6-8-10-12-13-15-17-24(25)23-19-18-21(20-26(3,4)5)22(23)16-14-11-9-7-2/h16,20,23-25H,6-15,17-19H2,1-5H3/b21-20+,22-16-/t23-,24+/m1/s1
InChIKeyYHDPAPINDSIAOL-ODXBVOBVSA-N
XLogP7.82
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.72
LogP ≤ 57.82
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'}

Analyze (1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-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

cis-(1S,2R)-2-[(1E,3E,5E)-3-methyltrideca-1,3,5-trienyl]cyclopentan-1-ol
CID 10492746
[(2E,12R,13S)-13-bicyclo[10.2.1]pentadeca-1(15),2-dienyl]oxy-tert-butyl-dimethylsilane
CID 11302087
(3R,4RS,7R)-1-(tert-Butyldimethylsilyloxy)-3,7,11-trimethyl-10-dodecen-4-ol
CID 23727931
(1E,3E,5R,6S,7R,8R,9S,11E)-8-[tert-butyl(dimethyl)silyl]oxy-1-iodo-3,5,7,9,11-pentamethyltrideca-1,3,11-trien-6-ol
CID 24740596
3,9-Dimethyl-6-prop-1-en-2-ylcyclotetradec-6-ene-1,4-diol
CID 90799998
(3S,6R)-6,10-dimethyl-5-methylidene-1-trimethylsilylundec-9-en-1-yn-3-ol
CID 134964317
[(2E)-13-bicyclo[10.2.1]pentadeca-1(15),2-dienyl]oxy-tert-butyl-dimethylsilane
CID 134982478
(4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol
CID 162404135
3-Hydroxy-2-isopropenyldecyltrimethylsilane
CID 101607920
1-(4-Trimethylsilylmethyl-3-cyclohexenyl)-5-methyl-4-hexen-1-ol
CID 101621183
8-Methoxy-2-methyl-6-methylene-7-(trimethylsilyl)methyl-2-pentadecene
CID 101635058
(2S,3R,4S,5Z,8S,9R,10R,11S,12S,13Z)-3,9-bis[[tert-butyl(dimethyl)silyl]oxy]-2,4,6,8,10,12-hexamethylhexadeca-5,13,15-triene-1,11-diol
CID 10984837

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol?
The IUPAC name of (1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol (CID 134982741) is (1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol.
What is the SMILES notation for (1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol?
The canonical SMILES for (1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol is CCCCC/C=C1C(=C/[Si](C)(C)C)/CC[C@H]/1[C@@H](O)CCCCCCCC.
What is the InChIKey of (1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol?
The InChIKey is YHDPAPINDSIAOL-ODXBVOBVSA-N. The full InChI is InChI=1S/C24H46OSi/c1-6-8-10-12-13-15-17-24(25)23-19-18-21(20-26(3,4)5)22(23)16-14-11-9-7-2/h16,20,23-25H,6-15,17-19H2,1-5H3/b21-20+,22-16-/t23-,24+/m1/s1.
What are the key properties of (1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol?
(1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol has a molecular weight of 378.72 g/mol, XLogP of 7.82, 13 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[(1R,2E,3E)-2-hexylidene-3-(trimethylsilylmethylidene)cyclopentyl]nonan-1-ol is sourced from PubChem (CID 134982741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).