2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene

C19H26S — CID 58462658

IUPAC2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene
SMILESCC(C)c1cccc(-c2cc(C(C)C)c(C(C)C)s2)c1
InChIInChI=1S/C19H26S/c1-12(2)15-8-7-9-16(10-15)18-11-17(13(3)4)19(20-18)14(5)6/h7-14H,1-6H3
InChIKeyCUESQRAVTGXJIP-UHFFFAOYSA-N
MW286.48 g/mol
LogP6.79
Rot. Bonds4

About 2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene

2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene (PubChem CID 58462658) has the molecular formula C19H26S and a molecular weight of 286.48 g/mol. Its IUPAC name is 2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene.

Molecular Properties

Compound Name2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene
PubChem CID58462658
Molecular FormulaC19H26S
Molecular Weight286.48 g/mol
Exact Mass286.18
IUPAC Name2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene
SMILESCC(C)c1cccc(-c2cc(C(C)C)c(C(C)C)s2)c1
InChIInChI=1S/C19H26S/c1-12(2)15-8-7-9-16(10-15)18-11-17(13(3)4)19(20-18)14(5)6/h7-14H,1-6H3
InChIKeyCUESQRAVTGXJIP-UHFFFAOYSA-N
XLogP6.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.48
LogP ≤ 56.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-propan-2-ylphenyl)thiophene
CID 57011596
5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene
CID 153324384
2-propan-2-yl-4-(3-propan-2-ylphenyl)-1-(trifluoromethyl)benzene
CID 155328294
2-[3-(3-propan-2-ylphenyl)phenyl]propan-2-ol
CID 170591106
N-[[5-(3-propan-2-ylphenyl)thiophen-2-yl]methyl]ethanamine
CID 43287164
1-phenyl-4-(3-propan-2-ylphenyl)benzene;1-phenyl-4-(4-propan-2-ylphenyl)benzene
CID 160951739
5-(3-propan-2-ylphenyl)-1H-pyrazole
CID 58101929
2,7-bis(3-propan-2-ylphenyl)-9H-carbazole
CID 118528823
1-methoxy-3-(3-propan-2-ylphenyl)benzene
CID 23110868
1,3-di(propan-2-yl)benzene;1,4-di(propan-2-yl)benzene;ethane
CID 158231247
2-(3-propan-2-ylphenyl)-1,3-thiazole
CID 22945701
4-tert-butyl-2-methyl-1-(3-propan-2-ylphenyl)benzene
CID 165380290

Frequently Asked Questions

What is the IUPAC name of 2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene?
The IUPAC name of 2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene (CID 58462658) is 2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene.
What is the SMILES notation for 2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene?
The canonical SMILES for 2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene is CC(C)c1cccc(-c2cc(C(C)C)c(C(C)C)s2)c1.
What is the InChIKey of 2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene?
The InChIKey is CUESQRAVTGXJIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26S/c1-12(2)15-8-7-9-16(10-15)18-11-17(13(3)4)19(20-18)14(5)6/h7-14H,1-6H3.
What are the key properties of 2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene?
2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene has a molecular weight of 286.48 g/mol, XLogP of 6.79, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-di(propan-2-yl)-5-(3-propan-2-ylphenyl)thiophene is sourced from PubChem (CID 58462658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).