[(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane

C32H52 — CID 14544622

IUPAC[(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)C1CC1
InChIInChI=1S/C32H52/c1-26(2)14-10-17-29(5)20-11-18-27(3)15-8-9-16-28(4)19-12-21-30(6)22-13-23-31(7)32-24-25-32/h14-16,20-21,23,32H,8-13,17-19,22,24-25H2,1-7H3/b27-15+,28-16+,29-20+,30-21+,31-23+
InChIKeyHKWKUDAFIYUXJR-UGMXIYSVSA-N
MW436.77 g/mol
LogP11.00
Rot. Bonds16

About [(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane

[(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane (PubChem CID 14544622) has the molecular formula C32H52 and a molecular weight of 436.77 g/mol. Its IUPAC name is [(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane.

Molecular Properties

Compound Name[(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane
PubChem CID14544622
Molecular FormulaC32H52
Molecular Weight436.77 g/mol
Exact Mass436.41
IUPAC Name[(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)C1CC1
InChIInChI=1S/C32H52/c1-26(2)14-10-17-29(5)20-11-18-27(3)15-8-9-16-28(4)19-12-21-30(6)22-13-23-31(7)32-24-25-32/h14-16,20-21,23,32H,8-13,17-19,22,24-25H2,1-7H3/b27-15+,28-16+,29-20+,30-21+,31-23+
InChIKeyHKWKUDAFIYUXJR-UGMXIYSVSA-N
XLogP11.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500436.77
LogP ≤ 511.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane?
The IUPAC name of [(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane (CID 14544622) is [(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane.
What is the SMILES notation for [(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane?
The canonical SMILES for [(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane is CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)C1CC1.
What is the InChIKey of [(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane?
The InChIKey is HKWKUDAFIYUXJR-UGMXIYSVSA-N. The full InChI is InChI=1S/C32H52/c1-26(2)14-10-17-29(5)20-11-18-27(3)15-8-9-16-28(4)19-12-21-30(6)22-13-23-31(7)32-24-25-32/h14-16,20-21,23,32H,8-13,17-19,22,24-25H2,1-7H3/b27-15+,28-16+,29-20+,30-21+,31-23+.
What are the key properties of [(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane?
[(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane has a molecular weight of 436.77 g/mol, XLogP of 11.00, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(2E,6E,10E,14E,18E)-6,10,15,19,23-pentamethyltetracosa-2,6,10,14,18,22-hexaen-2-yl]cyclopropane is sourced from PubChem (CID 14544622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).