Aheprxguubccfr-yyiausfcsa-

C19H28O5 — CID 15168619

IUPAC—
SMILESCOC1=C[C@H]2OC3(CCCCC3)O[C@H]2[C@@H]2OC3(CCCCC3)O[C@@H]12
InChIInChI=1S/C19H28O5/c1-20-13-12-14-16(23-18(21-14)8-4-2-5-9-18)17-15(13)22-19(24-17)10-6-3-7-11-19/h12,14-17H,2-11H2,1H3/t14-,15+,16-,17-/m1/s1
InChIKeyAHEPRXGUUBCCFR-YYIAUSFCSA-N
MW336.43 g/mol
LogP3.42
Rot. Bonds1

About Aheprxguubccfr-yyiausfcsa-

Aheprxguubccfr-yyiausfcsa- (PubChem CID 15168619) has the molecular formula C19H28O5 and a molecular weight of 336.43 g/mol.

Molecular Properties

Compound NameAheprxguubccfr-yyiausfcsa-
PubChem CID15168619
Molecular FormulaC19H28O5
Molecular Weight336.43 g/mol
Exact Mass336.19
IUPAC Name—
SMILESCOC1=C[C@H]2OC3(CCCCC3)O[C@H]2[C@@H]2OC3(CCCCC3)O[C@@H]12
InChIInChI=1S/C19H28O5/c1-20-13-12-14-16(23-18(21-14)8-4-2-5-9-18)17-15(13)22-19(24-17)10-6-3-7-11-19/h12,14-17H,2-11H2,1H3/t14-,15+,16-,17-/m1/s1
InChIKeyAHEPRXGUUBCCFR-YYIAUSFCSA-N
XLogP3.42
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.43
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of Aheprxguubccfr-yyiausfcsa-?
The IUPAC name of Aheprxguubccfr-yyiausfcsa- (CID 15168619) is not available.
What is the SMILES notation for Aheprxguubccfr-yyiausfcsa-?
The canonical SMILES for Aheprxguubccfr-yyiausfcsa- is COC1=C[C@H]2OC3(CCCCC3)O[C@H]2[C@@H]2OC3(CCCCC3)O[C@@H]12.
What is the InChIKey of Aheprxguubccfr-yyiausfcsa-?
The InChIKey is AHEPRXGUUBCCFR-YYIAUSFCSA-N. The full InChI is InChI=1S/C19H28O5/c1-20-13-12-14-16(23-18(21-14)8-4-2-5-9-18)17-15(13)22-19(24-17)10-6-3-7-11-19/h12,14-17H,2-11H2,1H3/t14-,15+,16-,17-/m1/s1.
What are the key properties of Aheprxguubccfr-yyiausfcsa-?
Aheprxguubccfr-yyiausfcsa- has a molecular weight of 336.43 g/mol, XLogP of 3.42, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for Aheprxguubccfr-yyiausfcsa- is sourced from PubChem (CID 15168619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).