(3-cyclobutylphenyl)-thiophen-3-ylmethanone

C15H14OS — CID 114601713

IUPAC(3-cyclobutylphenyl)-thiophen-3-ylmethanone
SMILESO=C(c1ccsc1)c1cccc(C2CCC2)c1
InChIInChI=1S/C15H14OS/c16-15(14-7-8-17-10-14)13-6-2-5-12(9-13)11-3-1-4-11/h2,5-11H,1,3-4H2
InChIKeyVIGFWHMNJCFDAV-UHFFFAOYSA-N
MW242.34 g/mol
LogP4.25
Rot. Bonds3

About (3-cyclobutylphenyl)-thiophen-3-ylmethanone

(3-cyclobutylphenyl)-thiophen-3-ylmethanone (PubChem CID 114601713) has the molecular formula C15H14OS and a molecular weight of 242.34 g/mol. Its IUPAC name is (3-cyclobutylphenyl)-thiophen-3-ylmethanone.

Molecular Properties

Compound Name(3-cyclobutylphenyl)-thiophen-3-ylmethanone
PubChem CID114601713
Molecular FormulaC15H14OS
Molecular Weight242.34 g/mol
Exact Mass242.08
IUPAC Name(3-cyclobutylphenyl)-thiophen-3-ylmethanone
SMILESO=C(c1ccsc1)c1cccc(C2CCC2)c1
InChIInChI=1S/C15H14OS/c16-15(14-7-8-17-10-14)13-6-2-5-12(9-13)11-3-1-4-11/h2,5-11H,1,3-4H2
InChIKeyVIGFWHMNJCFDAV-UHFFFAOYSA-N
XLogP4.25
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.34
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4-aminophenyl)-(3-cyclobutylphenyl)methanone
CID 114607433
[4-(oxan-4-yl)phenyl]-thiophen-3-ylmethanone
CID 135283503
(3-cyclobutylphenyl)-(1-hydroxycyclopentyl)methanone
CID 103447908
(3-bromo-2-chlorophenyl)-(3-cyclobutylphenyl)methanone
CID 115814752
(3-cyclobutylphenyl)-(2,6-difluoro-3-methylphenyl)methanone
CID 115814484
(3-cyclobutylphenyl)-(2-methylfuran-3-yl)methanone
CID 114602102
azetidin-3-yl-(3-cyclobutylphenyl)methanone
CID 114607630
3-bicyclo[3.1.0]hexanyl-(3-cyclobutylphenyl)methanone
CID 115814566
1-(3-cyclobutylphenyl)-2-(cyclopentylamino)ethanone
CID 114607490
(3-cyclobutylphenyl)-(4-propylthiadiazol-5-yl)methanone
CID 105135149
3-amino-1-(3-cyclobutylphenyl)pentan-1-one
CID 114607770
methyl 3-cyclohexylbenzoate
CID 67160762

Frequently Asked Questions

What is the IUPAC name of (3-cyclobutylphenyl)-thiophen-3-ylmethanone?
The IUPAC name of (3-cyclobutylphenyl)-thiophen-3-ylmethanone (CID 114601713) is (3-cyclobutylphenyl)-thiophen-3-ylmethanone.
What is the SMILES notation for (3-cyclobutylphenyl)-thiophen-3-ylmethanone?
The canonical SMILES for (3-cyclobutylphenyl)-thiophen-3-ylmethanone is O=C(c1ccsc1)c1cccc(C2CCC2)c1.
What is the InChIKey of (3-cyclobutylphenyl)-thiophen-3-ylmethanone?
The InChIKey is VIGFWHMNJCFDAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14OS/c16-15(14-7-8-17-10-14)13-6-2-5-12(9-13)11-3-1-4-11/h2,5-11H,1,3-4H2.
What are the key properties of (3-cyclobutylphenyl)-thiophen-3-ylmethanone?
(3-cyclobutylphenyl)-thiophen-3-ylmethanone has a molecular weight of 242.34 g/mol, XLogP of 4.25, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclobutylphenyl)-thiophen-3-ylmethanone is sourced from PubChem (CID 114601713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).