N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine

C14H15N3S2 — CID 112643482

IUPACN-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine
SMILESCCNC(Cc1cncs1)c1cnc2ccsc2c1
InChIInChI=1S/C14H15N3S2/c1-2-16-13(6-11-8-15-9-19-11)10-5-14-12(17-7-10)3-4-18-14/h3-5,7-9,13,16H,2,6H2,1H3
InChIKeyYSCIZRAQYVVVBU-UHFFFAOYSA-N
MW289.43 g/mol
LogP3.65
Rot. Bonds5

About N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine

N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine (PubChem CID 112643482) has the molecular formula C14H15N3S2 and a molecular weight of 289.43 g/mol. Its IUPAC name is N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine.

Molecular Properties

Compound NameN-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine
PubChem CID112643482
Molecular FormulaC14H15N3S2
Molecular Weight289.43 g/mol
Exact Mass289.07
IUPAC NameN-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine
SMILESCCNC(Cc1cncs1)c1cnc2ccsc2c1
InChIInChI=1S/C14H15N3S2/c1-2-16-13(6-11-8-15-9-19-11)10-5-14-12(17-7-10)3-4-18-14/h3-5,7-9,13,16H,2,6H2,1H3
InChIKeyYSCIZRAQYVVVBU-UHFFFAOYSA-N
XLogP3.65
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.43
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-1-thieno[3,2-b]pyridin-6-yl-2-thiophen-2-ylethanamine
CID 81144170
N-ethyl-3-methyl-1-thieno[3,2-b]pyridin-6-ylbutan-1-amine
CID 81143603
1-(4-ethoxyphenyl)-N-ethyl-2-(1,3-thiazol-5-yl)ethanamine
CID 105030338
N-ethyl-2-(2-ethyl-1,2,4-triazol-3-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 81153919
N-ethyl-3-methylidene-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine
CID 81144073
N-ethyl-2-propoxy-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 81143217
N-[2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine
CID 81143134
[2-(4-bromothiophen-2-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]hydrazine
CID 105256508
N-ethyl-1-(furan-3-yl)-2-(1,3-thiazol-5-yl)ethanamine
CID 112643066
N-ethyl-1-(5-methylfuran-3-yl)-2-(1,3-thiazol-5-yl)ethanamine
CID 105030608
N-[2-(furan-2-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine
CID 83183572
N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine
CID 81144068

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine?
The IUPAC name of N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine (CID 112643482) is N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine.
What is the SMILES notation for N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine?
The canonical SMILES for N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine is CCNC(Cc1cncs1)c1cnc2ccsc2c1.
What is the InChIKey of N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine?
The InChIKey is YSCIZRAQYVVVBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3S2/c1-2-16-13(6-11-8-15-9-19-11)10-5-14-12(17-7-10)3-4-18-14/h3-5,7-9,13,16H,2,6H2,1H3.
What are the key properties of N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine?
N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine has a molecular weight of 289.43 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine is sourced from PubChem (CID 112643482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).