(6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene

C30H50 — CID 162475328

IUPAC(6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene
SMILESC=C(CC/C=C/C(C)CC/C=C(\C)CCC=C(C)C)CC/C=C(\C)CCC=C(C)C
InChIInChI=1S/C30H50/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h10,15-16,18,23-24,28H,5,9,11-14,17,19-22H2,1-4,6-8H3/b18-10+,29-23+,30-24+
InChIKeySMJUUAUGOONSSI-CMWMJNCKSA-N
MW410.73 g/mol
LogP10.46
Rot. Bonds16

About (6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene

(6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene (PubChem CID 162475328) has the molecular formula C30H50 and a molecular weight of 410.73 g/mol. Its IUPAC name is (6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene.

Molecular Properties

Compound Name(6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene
PubChem CID162475328
Molecular FormulaC30H50
Molecular Weight410.73 g/mol
Exact Mass410.39
IUPAC Name(6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene
SMILESC=C(CC/C=C/C(C)CC/C=C(\C)CCC=C(C)C)CC/C=C(\C)CCC=C(C)C
InChIInChI=1S/C30H50/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h10,15-16,18,23-24,28H,5,9,11-14,17,19-22H2,1-4,6-8H3/b18-10+,29-23+,30-24+
InChIKeySMJUUAUGOONSSI-CMWMJNCKSA-N
XLogP10.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.73
LogP ≤ 510.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene with MolForge

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Related Compounds

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CID 148658393
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CID 57030104
(3E)-5,9,13-trimethyltetradeca-3,8,12-trien-2-one
CID 91460202
(11Z)-6,10-dimethyltrideca-2,6,11-triene
CID 91509510
2,6-dimethyl-10-methylidenetrideca-2,6-diene
CID 141408483
(3S)-N,N-diethyl-3,7,11-trimethyldodeca-1,6,10-trien-1-amine
CID 123394667
22-ethenoxy-2,6,10,15,19-pentamethyldocosa-2,6,11,14,18-pentaene
CID 57278514
3,7,11,15,19,23,27,31,35,39,43,47,51,55,59,63,67,71,75,79,83,87-docosamethyloctaoctaconta-6,10,14,18,22,26,30,34,38,42,46,50,54,58,62,66,70,74,78,82,86-henicosaen-1-ol
CID 139698181
(6Z,10Z,14Z,18Z,22Z,26Z,30Z,34Z,38E,42E)-3,7,11,15,19,23,27,31,35,39,43,47-dodecamethyloctatetraconta-6,10,14,18,22,26,30,34,38,42,46-undecaen-1-ol
CID 91820232
3,7,11,15,19,23,27,31,35,39,43,47,51,55,59,63,67,71,75,79,83,87,91-tricosamethyldononaconta-6,10,14,18,22,26,30,34,38,42,46,50,54,58,62,66,70,74,78,82,86,90-docosaen-1-ol
CID 139698175
(6E,10E,14E,18E,22E,26Z,30E,34E,38E,42E,46Z,50E,54E,58E,62E,66E,70E,74Z)-3,7,11,15,19,23,27,31,35,39,43,47,51,55,59,63,67,71,75,79-icosamethyloctaconta-6,10,14,18,22,26,30,34,38,42,46,50,54,58,62,66,70,74,78-nonadecaen-1-ol
CID 11818896
2,8,12-trimethyl-3-methylidenetrideca-7,11-dien-4-ol
CID 163035462

Frequently Asked Questions

What is the IUPAC name of (6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene?
The IUPAC name of (6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene (CID 162475328) is (6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene.
What is the SMILES notation for (6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene?
The canonical SMILES for (6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene is C=C(CC/C=C/C(C)CC/C=C(\C)CCC=C(C)C)CC/C=C(\C)CCC=C(C)C.
What is the InChIKey of (6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene?
The InChIKey is SMJUUAUGOONSSI-CMWMJNCKSA-N. The full InChI is InChI=1S/C30H50/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h10,15-16,18,23-24,28H,5,9,11-14,17,19-22H2,1-4,6-8H3/b18-10+,29-23+,30-24+.
What are the key properties of (6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene?
(6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene has a molecular weight of 410.73 g/mol, XLogP of 10.46, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6E,11E,18E)-2,6,10,19,23-pentamethyl-15-methylidenetetracosa-2,6,11,18,22-pentaene is sourced from PubChem (CID 162475328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).