1-(2-thiophen-2-ylethyl)-4H-quinoline

C15H15NS — CID 174281222

IUPAC1-(2-thiophen-2-ylethyl)-4H-quinoline
SMILESC1=CN(CCc2cccs2)c2ccccc2C1
InChIInChI=1S/C15H15NS/c1-2-8-15-13(5-1)6-3-10-16(15)11-9-14-7-4-12-17-14/h1-5,7-8,10,12H,6,9,11H2
InChIKeyBCTAMZSGJRNDAX-UHFFFAOYSA-N
MW241.36 g/mol
LogP3.87
Rot. Bonds3

About 1-(2-thiophen-2-ylethyl)-4H-quinoline

1-(2-thiophen-2-ylethyl)-4H-quinoline (PubChem CID 174281222) has the molecular formula C15H15NS and a molecular weight of 241.36 g/mol. Its IUPAC name is 1-(2-thiophen-2-ylethyl)-4H-quinoline.

Molecular Properties

Compound Name1-(2-thiophen-2-ylethyl)-4H-quinoline
PubChem CID174281222
Molecular FormulaC15H15NS
Molecular Weight241.36 g/mol
Exact Mass241.09
IUPAC Name1-(2-thiophen-2-ylethyl)-4H-quinoline
SMILESC1=CN(CCc2cccs2)c2ccccc2C1
InChIInChI=1S/C15H15NS/c1-2-8-15-13(5-1)6-3-10-16(15)11-9-14-7-4-12-17-14/h1-5,7-8,10,12H,6,9,11H2
InChIKeyBCTAMZSGJRNDAX-UHFFFAOYSA-N
XLogP3.87
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

10-(2-thiophen-2-ylethyl)phenothiazine
CID 134853153
3-propyl-1-(2-thiophen-2-ylethyl)-2,3,4,5-tetrahydro-1,4-benzodiazepine
CID 79907403
4-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]ethyl]morpholine
CID 60575640
2-(2-thiophen-2-ylethyl)-3,4-dihydro-1H-isoquinolin-5-amine
CID 63775160
1-(2-thiophen-2-ylethyl)piperidine-4-carbonitrile
CID 62416012
2-[4-chloro-3-(2-fluorophenyl)butyl]thiophene
CID 79455066
1-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-3-(2-thiophen-2-ylethyl)imidazolidine-2,4,5-trione
CID 9401579
molecular hydrogen;2-thiophen-2-ylethanamine
CID 142393573
1-(3-fluoro-2-pyridinyl)-4-(2-thiophen-2-ylethyl)piperazine
CID 136513547
7-methyl-2-(2-thiophen-2-ylethyl)-3,4-dihydro-1H-isoquinoline
CID 175409113
2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane
CID 101066236
CID 59269201
CID 59269201

Frequently Asked Questions

What is the IUPAC name of 1-(2-thiophen-2-ylethyl)-4H-quinoline?
The IUPAC name of 1-(2-thiophen-2-ylethyl)-4H-quinoline (CID 174281222) is 1-(2-thiophen-2-ylethyl)-4H-quinoline.
What is the SMILES notation for 1-(2-thiophen-2-ylethyl)-4H-quinoline?
The canonical SMILES for 1-(2-thiophen-2-ylethyl)-4H-quinoline is C1=CN(CCc2cccs2)c2ccccc2C1.
What is the InChIKey of 1-(2-thiophen-2-ylethyl)-4H-quinoline?
The InChIKey is BCTAMZSGJRNDAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NS/c1-2-8-15-13(5-1)6-3-10-16(15)11-9-14-7-4-12-17-14/h1-5,7-8,10,12H,6,9,11H2.
What are the key properties of 1-(2-thiophen-2-ylethyl)-4H-quinoline?
1-(2-thiophen-2-ylethyl)-4H-quinoline has a molecular weight of 241.36 g/mol, XLogP of 3.87, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-thiophen-2-ylethyl)-4H-quinoline is sourced from PubChem (CID 174281222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).