2-methyl-5-(2-methylbutyl)thiophene

C10H16S — CID 88977809

IUPAC2-methyl-5-(2-methylbutyl)thiophene
SMILESCCC(C)Cc1ccc(C)s1
InChIInChI=1S/C10H16S/c1-4-8(2)7-10-6-5-9(3)11-10/h5-6,8H,4,7H2,1-3H3
InChIKeyZNBFQWPRVGTLRA-UHFFFAOYSA-N
MW168.31 g/mol
LogP3.65
Rot. Bonds3

About 2-methyl-5-(2-methylbutyl)thiophene

2-methyl-5-(2-methylbutyl)thiophene (PubChem CID 88977809) has the molecular formula C10H16S and a molecular weight of 168.31 g/mol. Its IUPAC name is 2-methyl-5-(2-methylbutyl)thiophene.

Molecular Properties

Compound Name2-methyl-5-(2-methylbutyl)thiophene
PubChem CID88977809
Molecular FormulaC10H16S
Molecular Weight168.31 g/mol
Exact Mass168.10
IUPAC Name2-methyl-5-(2-methylbutyl)thiophene
SMILESCCC(C)Cc1ccc(C)s1
InChIInChI=1S/C10H16S/c1-4-8(2)7-10-6-5-9(3)11-10/h5-6,8H,4,7H2,1-3H3
InChIKeyZNBFQWPRVGTLRA-UHFFFAOYSA-N
XLogP3.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.31
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-1-(5-methylthiophen-2-yl)propan-2-amine
CID 18656698
1-(5-methylthiophen-2-yl)propan-2-ol
CID 13111508
2-benzyl-5-(2-methylbutyl)thiophene
CID 57041002
[5-(2-methylbutyl)thiophen-2-yl]methanimine
CID 143618608
3-ethyl-N-[1-(5-methylthiophen-2-yl)propan-2-yl]triazol-4-amine
CID 114222537
2-N-[1-(5-methylthiophen-2-yl)propan-2-yl]propane-1,2-diamine
CID 103390068
methyl 2-[1-(5-methylthiophen-2-yl)propan-2-ylamino]butanoate
CID 113292625
N-[1-(5-methylthiophen-2-yl)propan-2-yl]cyclopropanamine
CID 103439266
acetylene;ethane;2-ethyl-5-methylthiophene
CID 143080420
2-methyl-N-[(5-methylthiophen-2-yl)methyl]pentan-1-amine
CID 62054518
N-butan-2-yl-2-[(5-methylthiophen-2-yl)methylamino]propanamide
CID 61067130
1-[(5-methylthiophen-2-yl)methyl-propan-2-ylamino]butan-2-ol
CID 24713710

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(2-methylbutyl)thiophene?
The IUPAC name of 2-methyl-5-(2-methylbutyl)thiophene (CID 88977809) is 2-methyl-5-(2-methylbutyl)thiophene.
What is the SMILES notation for 2-methyl-5-(2-methylbutyl)thiophene?
The canonical SMILES for 2-methyl-5-(2-methylbutyl)thiophene is CCC(C)Cc1ccc(C)s1.
What is the InChIKey of 2-methyl-5-(2-methylbutyl)thiophene?
The InChIKey is ZNBFQWPRVGTLRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16S/c1-4-8(2)7-10-6-5-9(3)11-10/h5-6,8H,4,7H2,1-3H3.
What are the key properties of 2-methyl-5-(2-methylbutyl)thiophene?
2-methyl-5-(2-methylbutyl)thiophene has a molecular weight of 168.31 g/mol, XLogP of 3.65, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(2-methylbutyl)thiophene is sourced from PubChem (CID 88977809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).