N-ethyl-1-(5-methylthiophen-2-yl)ethanamine

C9H15NS — CID 24705103

IUPACN-ethyl-1-(5-methylthiophen-2-yl)ethanamine
SMILESCCNC(C)c1ccc(C)s1
InChIInChI=1S/C9H15NS/c1-4-10-8(3)9-6-5-7(2)11-9/h5-6,8,10H,4H2,1-3H3
InChIKeyXHDCLOFNSSQEGD-UHFFFAOYSA-N
MW169.29 g/mol
LogP2.73
Rot. Bonds3

About N-ethyl-1-(5-methylthiophen-2-yl)ethanamine

N-ethyl-1-(5-methylthiophen-2-yl)ethanamine (PubChem CID 24705103) has the molecular formula C9H15NS and a molecular weight of 169.29 g/mol. Its IUPAC name is N-ethyl-1-(5-methylthiophen-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(5-methylthiophen-2-yl)ethanamine
PubChem CID24705103
Molecular FormulaC9H15NS
Molecular Weight169.29 g/mol
Exact Mass169.09
IUPAC NameN-ethyl-1-(5-methylthiophen-2-yl)ethanamine
SMILESCCNC(C)c1ccc(C)s1
InChIInChI=1S/C9H15NS/c1-4-10-8(3)9-6-5-7(2)11-9/h5-6,8,10H,4H2,1-3H3
InChIKeyXHDCLOFNSSQEGD-UHFFFAOYSA-N
XLogP2.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.29
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-N-[1-(5-methylthiophen-2-yl)ethyl]butan-1-amine
CID 61473499
2-[[(1R)-1-(5-methylthiophen-2-yl)ethyl]amino]ethanol
CID 93025500
(2R)-1-[1-(5-methylthiophen-2-yl)ethylamino]propan-2-ol
CID 103906827
N-(2-fluoroethyl)-1-(5-methylthiophen-2-yl)ethanamine
CID 80694036
N-[1-(5-methylthiophen-2-yl)ethyl]hexan-1-amine
CID 43109777
N-[1-(5-methylthiophen-2-yl)ethyl]nonan-1-amine
CID 63490848
N-[1-(5-methylthiophen-2-yl)ethyl]heptan-1-amine
CID 63455494
2,2,2-trifluoro-N-[1-(5-methylthiophen-2-yl)ethyl]ethanamine
CID 24696263
2,2-diethoxy-N-[1-(5-methylthiophen-2-yl)ethyl]ethanamine
CID 79547244
2,3,3-trimethyl-N-[1-(5-methylthiophen-2-yl)ethyl]butan-1-amine
CID 83141831
2-methylsulfanyl-N-[1-(5-methylthiophen-2-yl)ethyl]propan-1-amine
CID 115895530
3,3-dimethyl-N-[1-(5-methylthiophen-2-yl)ethyl]butan-1-amine
CID 61473830

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-methylthiophen-2-yl)ethanamine?
The IUPAC name of N-ethyl-1-(5-methylthiophen-2-yl)ethanamine (CID 24705103) is N-ethyl-1-(5-methylthiophen-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-1-(5-methylthiophen-2-yl)ethanamine?
The canonical SMILES for N-ethyl-1-(5-methylthiophen-2-yl)ethanamine is CCNC(C)c1ccc(C)s1.
What is the InChIKey of N-ethyl-1-(5-methylthiophen-2-yl)ethanamine?
The InChIKey is XHDCLOFNSSQEGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NS/c1-4-10-8(3)9-6-5-7(2)11-9/h5-6,8,10H,4H2,1-3H3.
What are the key properties of N-ethyl-1-(5-methylthiophen-2-yl)ethanamine?
N-ethyl-1-(5-methylthiophen-2-yl)ethanamine has a molecular weight of 169.29 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-methylthiophen-2-yl)ethanamine is sourced from PubChem (CID 24705103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).