3-(2-cyclopropylethyl)thiophene

C9H12S — CID 159324839

IUPAC3-(2-cyclopropylethyl)thiophene
SMILESc1cc(CCC2CC2)cs1
InChIInChI=1S/C9H12S/c1-2-8(1)3-4-9-5-6-10-7-9/h5-8H,1-4H2
InChIKeyLEFOBFBKSMFNDD-UHFFFAOYSA-N
MW152.26 g/mol
LogP3.09
Rot. Bonds3

About 3-(2-cyclopropylethyl)thiophene

3-(2-cyclopropylethyl)thiophene (PubChem CID 159324839) has the molecular formula C9H12S and a molecular weight of 152.26 g/mol. Its IUPAC name is 3-(2-cyclopropylethyl)thiophene.

Molecular Properties

Compound Name3-(2-cyclopropylethyl)thiophene
PubChem CID159324839
Molecular FormulaC9H12S
Molecular Weight152.26 g/mol
Exact Mass152.07
IUPAC Name3-(2-cyclopropylethyl)thiophene
SMILESc1cc(CCC2CC2)cs1
InChIInChI=1S/C9H12S/c1-2-8(1)3-4-9-5-6-10-7-9/h5-8H,1-4H2
InChIKeyLEFOBFBKSMFNDD-UHFFFAOYSA-N
XLogP3.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.26
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(2-thiophen-3-ylethyl)cyclopentan-1-amine
CID 64504109
3-(2-thiophen-3-ylethyl)azetidine
CID 79451396
N-ethyl-3-(2-thiophen-3-ylethyl)cyclopentan-1-amine
CID 64504261
3-(2-thiophen-3-ylethyl)azepane
CID 104680659
2-(2-thiophen-3-ylethyl)-1,3-dioxolane
CID 71386496
1-cyclohexyl-5-thiophen-3-ylpentan-3-ol
CID 115798364
1-cyclopentyl-5-thiophen-3-ylpentan-3-amine
CID 115857138
1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine
CID 65423572
2-methyl-3-(2-thiophen-3-ylethyl)oxirane
CID 83927729
N-methyl-1-[2-(2-thiophen-3-ylethyl)cyclopentyl]methanamine
CID 81034577
2-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine
CID 60732816
1-(2-thiophen-3-ylethyl)piperidin-4-amine
CID 61474548

Frequently Asked Questions

What is the IUPAC name of 3-(2-cyclopropylethyl)thiophene?
The IUPAC name of 3-(2-cyclopropylethyl)thiophene (CID 159324839) is 3-(2-cyclopropylethyl)thiophene.
What is the SMILES notation for 3-(2-cyclopropylethyl)thiophene?
The canonical SMILES for 3-(2-cyclopropylethyl)thiophene is c1cc(CCC2CC2)cs1.
What is the InChIKey of 3-(2-cyclopropylethyl)thiophene?
The InChIKey is LEFOBFBKSMFNDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12S/c1-2-8(1)3-4-9-5-6-10-7-9/h5-8H,1-4H2.
What are the key properties of 3-(2-cyclopropylethyl)thiophene?
3-(2-cyclopropylethyl)thiophene has a molecular weight of 152.26 g/mol, XLogP of 3.09, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclopropylethyl)thiophene is sourced from PubChem (CID 159324839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).