1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine

C24H39NO — CID 91317525

IUPAC1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine
SMILESCC(C)=CCCC(C)=CCCC(C)=CCC1OC=C(C)C1N1CCCC1
InChIInChI=1S/C24H39NO/c1-19(2)10-8-11-20(3)12-9-13-21(4)14-15-23-24(22(5)18-26-23)25-16-6-7-17-25/h10,12,14,18,23-24H,6-9,11,13,15-17H2,1-5H3
InChIKeyIWDIRMNCVWXGBX-UHFFFAOYSA-N
MW357.58 g/mol
LogP6.56
Rot. Bonds9

About 1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine

1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine (PubChem CID 91317525) has the molecular formula C24H39NO and a molecular weight of 357.58 g/mol. Its IUPAC name is 1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine.

Molecular Properties

Compound Name1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine
PubChem CID91317525
Molecular FormulaC24H39NO
Molecular Weight357.58 g/mol
Exact Mass357.30
IUPAC Name1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine
SMILESCC(C)=CCCC(C)=CCCC(C)=CCC1OC=C(C)C1N1CCCC1
InChIInChI=1S/C24H39NO/c1-19(2)10-8-11-20(3)12-9-13-21(4)14-15-23-24(22(5)18-26-23)25-16-6-7-17-25/h10,12,14,18,23-24H,6-9,11,13,15-17H2,1-5H3
InChIKeyIWDIRMNCVWXGBX-UHFFFAOYSA-N
XLogP6.56
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.58
LogP ≤ 56.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine 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

3-methyl-2-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]-2,5-dihydrothiophene 1-oxide
CID 164597146
tricyclohexyl(3,7,11-trimethyldodeca-2,6,10-trienyl)phosphanium bromide
CID 160956477
(10E)-2,6,11,15-tetramethylhexadeca-2,6,10,14-tetraene
CID 173158415
(6Z,10Z,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 24871318
(14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 131954652
2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 173324782
(6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene;2-methyloxaziridine
CID 20839770
(6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene;1-[(1R,2S)-2-methyl-1-thiophen-2-ylcyclohexyl]piperidine
CID 44537953
2-(3,7-dimethylocta-2,6-dienyl)cyclohexane-1,3-dione
CID 70579950
2-(3,7-dimethylocta-2,6-dienyl)-3-hydroxy-4-methyl-2H-furan-5-one
CID 69099244
(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyl-1-nitrosotetracosa-2,6,10,14,18,22-hexaene
CID 118054389
(6E,10E,15E)-2,6,10,16,20-pentamethylhenicosa-2,6,10,15,19-pentaene
CID 58662859

Frequently Asked Questions

What is the IUPAC name of 1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine?
The IUPAC name of 1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine (CID 91317525) is 1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine.
What is the SMILES notation for 1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine?
The canonical SMILES for 1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine is CC(C)=CCCC(C)=CCCC(C)=CCC1OC=C(C)C1N1CCCC1.
What is the InChIKey of 1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine?
The InChIKey is IWDIRMNCVWXGBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H39NO/c1-19(2)10-8-11-20(3)12-9-13-21(4)14-15-23-24(22(5)18-26-23)25-16-6-7-17-25/h10,12,14,18,23-24H,6-9,11,13,15-17H2,1-5H3.
What are the key properties of 1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine?
1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine has a molecular weight of 357.58 g/mol, XLogP of 6.56, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)-2,3-dihydrofuran-3-yl]pyrrolidine is sourced from PubChem (CID 91317525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).