CID 10917160

C24H42O5Si — CID 10917160

IUPAC—
SMILESCOC(C)(C)[C@@H]1OC2(CC[C@H]3C4(CC4)C(=O)C([Si](C)(C)C)[C@]32C)O[C@H]1C(C)(C)OC
InChIInChI=1S/C24H42O5Si/c1-20(2,26-6)17-18(21(3,4)27-7)29-24(28-17)12-11-15-22(24,5)19(30(8,9)10)16(25)23(15)13-14-23/h15,17-19H,11-14H2,1-10H3/t15-,17-,18-,19?,22+/m1/s1
InChIKeyDERTVQTXBYQOBA-CWDKMRGGSA-N
MW438.68 g/mol
LogP4.80
Rot. Bonds5

About CID 10917160

CID 10917160 (PubChem CID 10917160) has the molecular formula C24H42O5Si and a molecular weight of 438.68 g/mol.

Molecular Properties

Compound NameCID 10917160
PubChem CID10917160
Molecular FormulaC24H42O5Si
Molecular Weight438.68 g/mol
Exact Mass438.28
IUPAC Name—
SMILESCOC(C)(C)[C@@H]1OC2(CC[C@H]3C4(CC4)C(=O)C([Si](C)(C)C)[C@]32C)O[C@H]1C(C)(C)OC
InChIInChI=1S/C24H42O5Si/c1-20(2,26-6)17-18(21(3,4)27-7)29-24(28-17)12-11-15-22(24,5)19(30(8,9)10)16(25)23(15)13-14-23/h15,17-19H,11-14H2,1-10H3/t15-,17-,18-,19?,22+/m1/s1
InChIKeyDERTVQTXBYQOBA-CWDKMRGGSA-N
XLogP4.80
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.68
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(1S,3aR,6R,6aR)-1,5,5-trimethyl-6-(2-trimethylsilylethoxymethoxy)-1,3,3a,4,6,6a-hexahydropentalen-2-one
CID 134922322
Tricyclo[6.3.0.0(1,5)]undecan-10-one, 4-[(2-methoxyethoxy)methoxy]-5,9-dimethyl-7-trimethylsilyl-
CID 560610
(3S,3aR,9aS)-3-[tert-butyl(dimethyl)silyl]oxy-9a-methylspiro[1,2,3,3a,4,6,7,8-octahydrocyclopenta[8]annulene-9,2'-1,3-dioxolane]-5-one
CID 15309935
(3R,3aS,9aR)-3-[tert-butyl(dimethyl)silyl]oxy-9a-methylspiro[1,2,3,3a,4,6,7,8-octahydrocyclopenta[8]annulene-9,2'-1,3-dioxolane]-5-one
CID 102240431
(1R,3aR,9aS)-1-[tert-butyl(dimethyl)silyl]oxy-6-deuterio-3a-methylspiro[1,2,3,5,6,7,9,9a-octahydrocyclopenta[8]annulene-4,2'-1,3-dioxolane]-8-one
CID 102240433
(3aR,6aS)-5-[tert-butyl(dimethyl)silyl]oxy-4-(2-methoxypropan-2-yloxymethyl)-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-one
CID 54135032
methyl (1S,3R,3aR,6R,6aR)-3-[tert-butyl(dimethyl)silyl]oxy-3-methyl-6-(2-methyl-1,3-dioxolan-2-yl)-2,3a,4,5,6,6a-hexahydro-1H-pentalene-1-carboxylate
CID 10572976
CID 10915536
CID 10915536
(3S,3aS,4'R,5'R,6aS)-3-[(3S)-3-[tert-butyl(dimethyl)silyl]oxyoct-1-ynyl]-4',5'-dimethylspiro[1,3,3a,4,5,6a-hexahydropentalene-6,2'-1,3-dioxolane]-2-one
CID 10963681

Frequently Asked Questions

What is the IUPAC name of CID 10917160?
The IUPAC name of CID 10917160 (CID 10917160) is not available.
What is the SMILES notation for CID 10917160?
The canonical SMILES for CID 10917160 is COC(C)(C)[C@@H]1OC2(CC[C@H]3C4(CC4)C(=O)C([Si](C)(C)C)[C@]32C)O[C@H]1C(C)(C)OC.
What is the InChIKey of CID 10917160?
The InChIKey is DERTVQTXBYQOBA-CWDKMRGGSA-N. The full InChI is InChI=1S/C24H42O5Si/c1-20(2,26-6)17-18(21(3,4)27-7)29-24(28-17)12-11-15-22(24,5)19(30(8,9)10)16(25)23(15)13-14-23/h15,17-19H,11-14H2,1-10H3/t15-,17-,18-,19?,22+/m1/s1.
What are the key properties of CID 10917160?
CID 10917160 has a molecular weight of 438.68 g/mol, XLogP of 4.80, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10917160 is sourced from PubChem (CID 10917160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).