2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone

C14H18OS — CID 114969345

IUPAC2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone
SMILESO=C(CC1CCCC1)c1cc2c(s1)CCC2
InChIInChI=1S/C14H18OS/c15-12(8-10-4-1-2-5-10)14-9-11-6-3-7-13(11)16-14/h9-10H,1-8H2
InChIKeyPSEYZNOLTNOIIF-UHFFFAOYSA-N
MW234.36 g/mol
LogP4.00
Rot. Bonds3

About 2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone

2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone (PubChem CID 114969345) has the molecular formula C14H18OS and a molecular weight of 234.36 g/mol. Its IUPAC name is 2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone.

Molecular Properties

Compound Name2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone
PubChem CID114969345
Molecular FormulaC14H18OS
Molecular Weight234.36 g/mol
Exact Mass234.11
IUPAC Name2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone
SMILESO=C(CC1CCCC1)c1cc2c(s1)CCC2
InChIInChI=1S/C14H18OS/c15-12(8-10-4-1-2-5-10)14-9-11-6-3-7-13(11)16-14/h9-10H,1-8H2
InChIKeyPSEYZNOLTNOIIF-UHFFFAOYSA-N
XLogP4.00
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyloxy-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 83206357
2-amino-1-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanone
CID 10657175
2-ethoxy-1-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanone
CID 115782877
cyclohexyl(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone
CID 114962155
1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)pent-4-yn-1-one
CID 114972854
2-ethoxy-1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)ethanone
CID 115783007
bis(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone
CID 140811828
5-(2-cyclohexylacetyl)-2-methylthiophene-3-carbaldehyde
CID 82382673
5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(2-ethylcyclohexyl)methanone
CID 114973783
cyclobutyl(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone
CID 115811385
1-(5-bromo-4-chlorothiophen-2-yl)-2-cyclopentylethanone
CID 80531816
[4-(bromomethyl)piperidin-1-yl]-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)methanone
CID 80678205

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone?
The IUPAC name of 2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone (CID 114969345) is 2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone.
What is the SMILES notation for 2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone?
The canonical SMILES for 2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone is O=C(CC1CCCC1)c1cc2c(s1)CCC2.
What is the InChIKey of 2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone?
The InChIKey is PSEYZNOLTNOIIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18OS/c15-12(8-10-4-1-2-5-10)14-9-11-6-3-7-13(11)16-14/h9-10H,1-8H2.
What are the key properties of 2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone?
2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone has a molecular weight of 234.36 g/mol, XLogP of 4.00, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanone is sourced from PubChem (CID 114969345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).