N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine

C16H22N2OS — CID 105136035

IUPACN-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine
SMILESCCNC(Cc1ccc(CC)s1)c1cccnc1OC
InChIInChI=1S/C16H22N2OS/c1-4-12-8-9-13(20-12)11-15(17-5-2)14-7-6-10-18-16(14)19-3/h6-10,15,17H,4-5,11H2,1-3H3
InChIKeyLDOQCXNRZDJUKC-UHFFFAOYSA-N
MW290.43 g/mol
LogP3.61
Rot. Bonds7

About N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine

N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine (PubChem CID 105136035) has the molecular formula C16H22N2OS and a molecular weight of 290.43 g/mol. Its IUPAC name is N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine
PubChem CID105136035
Molecular FormulaC16H22N2OS
Molecular Weight290.43 g/mol
Exact Mass290.15
IUPAC NameN-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine
SMILESCCNC(Cc1ccc(CC)s1)c1cccnc1OC
InChIInChI=1S/C16H22N2OS/c1-4-12-8-9-13(20-12)11-15(17-5-2)14-7-6-10-18-16(14)19-3/h6-10,15,17H,4-5,11H2,1-3H3
InChIKeyLDOQCXNRZDJUKC-UHFFFAOYSA-N
XLogP3.61
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.43
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine
CID 105135936
2-(3,5-dimethylphenyl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine
CID 105099080
N-ethyl-1-(2-methoxy-3-pyridinyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 105167171
N-ethyl-1-(2-methoxy-3-pyridinyl)-3-phenylpropan-1-amine
CID 105094165
2-(5-chlorothiophen-2-yl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine
CID 105135284
N-ethyl-2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methoxy-3-pyridinyl)ethanamine
CID 105162407
N-ethyl-2-(5-ethylthiophen-2-yl)-1-(3-methoxyphenyl)ethanamine
CID 62605862
2-(4-bromo-1,3-dimethylpyrazol-5-yl)-N-ethyl-1-(2-methoxy-3-pyridinyl)ethanamine
CID 105160979
N-ethyl-1-(5-ethylthiophen-2-yl)-4-pyridin-2-ylbutan-2-amine
CID 105136068
[1-(2-methoxy-3-pyridinyl)-2-thiophen-2-ylethyl]hydrazine
CID 105295492
N-[1-(2-methoxy-3-pyridinyl)-2-pyridin-2-ylethyl]propan-1-amine
CID 105158151
1-(2-methoxy-3-pyridinyl)propylhydrazine
CID 105281861

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine?
The IUPAC name of N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine (CID 105136035) is N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine.
What is the SMILES notation for N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine?
The canonical SMILES for N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine is CCNC(Cc1ccc(CC)s1)c1cccnc1OC.
What is the InChIKey of N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine?
The InChIKey is LDOQCXNRZDJUKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2OS/c1-4-12-8-9-13(20-12)11-15(17-5-2)14-7-6-10-18-16(14)19-3/h6-10,15,17H,4-5,11H2,1-3H3.
What are the key properties of N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine?
N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine has a molecular weight of 290.43 g/mol, XLogP of 3.61, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(5-ethylthiophen-2-yl)-1-(2-methoxy-3-pyridinyl)ethanamine is sourced from PubChem (CID 105136035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).