methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane)

C147H276N4O5S5 — CID 158343708

IUPACmethane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane)
SMILESC.C.C.C.C.C.C.C.C.C.C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C/C=C/c1ccco1.CC(C)C/C=C/c1cccs1.CC(C)C/C=C/c1ncco1.CC(C)C/C=C/c1nccs1.CC(C)CC#Cc1ccco1.CC(C)CC#Cc1cccs1.CC(C)CC#Cc1ncco1.CC(C)CC#Cc1nccs1.CC(C)CCCc1ccco1.CC(C)CCCc1cccs1
InChIInChI=1S/C10H16O.C10H14O.C10H12O.C10H16S.C10H14S.C10H12S.C9H13NO.C9H11NO.C9H13NS.C9H11NS.10C4H10.11CH4/c6*1-9(2)5-3-6-10-7-4-8-11-10;4*1-8(2)4-3-5-9-10-6-7-11-9;10*1-4(2)3;;;;;;;;;;;/h4,7-9H,3,5-6H2,1-2H3;3-4,6-9H,5H2,1-2H3;4,7-9H,5H2,1-2H3;4,7-9H,3,5-6H2,1-2H3;3-4,6-9H,5H2,1-2H3;4,7-9H,5H2,1-2H3;3,5-8H,4H2,1-2H3;6-8H,4H2,1-2H3;3,5-8H,4H2,1-2H3;6-8H,4H2,1-2H3;10*4H,1-3H3;11*1H4/b;6-3+;;;6-3+;;5-3+;;5-3+;;;;;;;;;;;;;;;;;;;;;;
InChIKeyGRLVENYBTICPJM-GEUDGQBMSA-N
MW2340.18 g/mol
LogP54.12
Rot. Bonds24

About methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane)

methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane) (PubChem CID 158343708) has the molecular formula C147H276N4O5S5 and a molecular weight of 2340.18 g/mol. Its IUPAC name is methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane).

Molecular Properties

Compound Namemethane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane)
PubChem CID158343708
Molecular FormulaC147H276N4O5S5
Molecular Weight2340.18 g/mol
Exact Mass2338.01
IUPAC Namemethane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane)
SMILESC.C.C.C.C.C.C.C.C.C.C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C/C=C/c1ccco1.CC(C)C/C=C/c1cccs1.CC(C)C/C=C/c1ncco1.CC(C)C/C=C/c1nccs1.CC(C)CC#Cc1ccco1.CC(C)CC#Cc1cccs1.CC(C)CC#Cc1ncco1.CC(C)CC#Cc1nccs1.CC(C)CCCc1ccco1.CC(C)CCCc1cccs1
InChIInChI=1S/C10H16O.C10H14O.C10H12O.C10H16S.C10H14S.C10H12S.C9H13NO.C9H11NO.C9H13NS.C9H11NS.10C4H10.11CH4/c6*1-9(2)5-3-6-10-7-4-8-11-10;4*1-8(2)4-3-5-9-10-6-7-11-9;10*1-4(2)3;;;;;;;;;;;/h4,7-9H,3,5-6H2,1-2H3;3-4,6-9H,5H2,1-2H3;4,7-9H,5H2,1-2H3;4,7-9H,3,5-6H2,1-2H3;3-4,6-9H,5H2,1-2H3;4,7-9H,5H2,1-2H3;3,5-8H,4H2,1-2H3;6-8H,4H2,1-2H3;3,5-8H,4H2,1-2H3;6-8H,4H2,1-2H3;10*4H,1-3H3;11*1H4/b;6-3+;;;6-3+;;5-3+;;5-3+;;;;;;;;;;;;;;;;;;;;;;
InChIKeyGRLVENYBTICPJM-GEUDGQBMSA-N
XLogP54.12
TPSA117.26 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds24
Heavy Atoms161
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002340.18
LogP ≤ 554.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

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

Analyze methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane) with MolForge

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Frequently Asked Questions

What is the IUPAC name of methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane)?
The IUPAC name of methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane) (CID 158343708) is methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane).
What is the SMILES notation for methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane)?
The canonical SMILES for methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane) is C.C.C.C.C.C.C.C.C.C.C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C/C=C/c1ccco1.CC(C)C/C=C/c1cccs1.CC(C)C/C=C/c1ncco1.CC(C)C/C=C/c1nccs1.CC(C)CC#Cc1ccco1.CC(C)CC#Cc1cccs1.CC(C)CC#Cc1ncco1.CC(C)CC#Cc1nccs1.CC(C)CCCc1ccco1.CC(C)CCCc1cccs1.
What is the InChIKey of methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane)?
The InChIKey is GRLVENYBTICPJM-GEUDGQBMSA-N. The full InChI is InChI=1S/C10H16O.C10H14O.C10H12O.C10H16S.C10H14S.C10H12S.C9H13NO.C9H11NO.C9H13NS.C9H11NS.10C4H10.11CH4/c6*1-9(2)5-3-6-10-7-4-8-11-10;4*1-8(2)4-3-5-9-10-6-7-11-9;10*1-4(2)3;;;;;;;;;;;/h4,7-9H,3,5-6H2,1-2H3;3-4,6-9H,5H2,1-2H3;4,7-9H,5H2,1-2H3;4,7-9H,3,5-6H2,1-2H3;3-4,6-9H,5H2,1-2H3;4,7-9H,5H2,1-2H3;3,5-8H,4H2,1-2H3;6-8H,4H2,1-2H3;3,5-8H,4H2,1-2H3;6-8H,4H2,1-2H3;10*4H,1-3H3;11*1H4/b;6-3+;;;6-3+;;5-3+;;5-3+;;;;;;;;;;;;;;;;;;;;;;.
What are the key properties of methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane)?
methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane) has a molecular weight of 2340.18 g/mol, XLogP of 54.12, 24 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for methane;2-[(E)-4-methylpent-1-enyl]furan;2-[(E)-4-methylpent-1-enyl]-1,3-oxazole;2-[(E)-4-methylpent-1-enyl]-1,3-thiazole;2-[(E)-4-methylpent-1-enyl]thiophene;2-(4-methylpentyl)furan;2-(4-methylpentyl)thiophene;2-(4-methylpent-1-ynyl)furan;2-(4-methylpent-1-ynyl)-1,3-oxazole;2-(4-methylpent-1-ynyl)-1,3-thiazole;2-(4-methylpent-1-ynyl)thiophene;decakis(2-methylpropane) is sourced from PubChem (CID 158343708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).