5-cyclopropyl-2-ethylthieno[2,3-b]pyridine

C12H13NS — CID 171090119

IUPAC5-cyclopropyl-2-ethylthieno[2,3-b]pyridine
SMILESCCc1cc2cc(C3CC3)cnc2s1
InChIInChI=1S/C12H13NS/c1-2-11-6-9-5-10(8-3-4-8)7-13-12(9)14-11/h5-8H,2-4H2,1H3
InChIKeyCLWFDNVAKOLPFB-UHFFFAOYSA-N
MW203.31 g/mol
LogP3.74
Rot. Bonds2

About 5-cyclopropyl-2-ethylthieno[2,3-b]pyridine

5-cyclopropyl-2-ethylthieno[2,3-b]pyridine (PubChem CID 171090119) has the molecular formula C12H13NS and a molecular weight of 203.31 g/mol. Its IUPAC name is 5-cyclopropyl-2-ethylthieno[2,3-b]pyridine.

Molecular Properties

Compound Name5-cyclopropyl-2-ethylthieno[2,3-b]pyridine
PubChem CID171090119
Molecular FormulaC12H13NS
Molecular Weight203.31 g/mol
Exact Mass203.08
IUPAC Name5-cyclopropyl-2-ethylthieno[2,3-b]pyridine
SMILESCCc1cc2cc(C3CC3)cnc2s1
InChIInChI=1S/C12H13NS/c1-2-11-6-9-5-10(8-3-4-8)7-13-12(9)14-11/h5-8H,2-4H2,1H3
InChIKeyCLWFDNVAKOLPFB-UHFFFAOYSA-N
XLogP3.74
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.31
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-2-ethylthieno[2,3-b]pyridine
CID 91250034
2-[(6-bromo-3-fluoropyrrolo[3,2-c]pyridin-1-yl)methyl]-5-cyclopropylthieno[2,3-b]pyridine
CID 171089790
5-cyclopentyl-3-ethylpyridin-2-amine
CID 170760838
3-(4-ethylcyclohexyl)quinoline
CID 145078390
5-cyclopropyl-2-ethylpyridine;ethane
CID 142548928
2-cyclopentyl-6-ethylthieno[2,3-d]pyrimidin-4-amine
CID 55250109
5-cyclobutyl-2-ethylpyridin-3-amine
CID 83914783
trans-(1S,2S)-2-(3-chlorophenyl)-N-[4-[(5-cyclopropylthieno[2,3-b]pyridin-2-yl)methylamino]-2-pyridinyl]cyclopropane-1-carboxamide
CID 165133893
ethyl 3-cyclopropylquinoline-6-carboxylate
CID 139487727
4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103327219
6-(chloromethyl)-3-cyclopropylquinoline
CID 134178572
2-(4,4-dimethylcyclohexyl)-6-ethyl-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 65392053

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-ethylthieno[2,3-b]pyridine?
The IUPAC name of 5-cyclopropyl-2-ethylthieno[2,3-b]pyridine (CID 171090119) is 5-cyclopropyl-2-ethylthieno[2,3-b]pyridine.
What is the SMILES notation for 5-cyclopropyl-2-ethylthieno[2,3-b]pyridine?
The canonical SMILES for 5-cyclopropyl-2-ethylthieno[2,3-b]pyridine is CCc1cc2cc(C3CC3)cnc2s1.
What is the InChIKey of 5-cyclopropyl-2-ethylthieno[2,3-b]pyridine?
The InChIKey is CLWFDNVAKOLPFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NS/c1-2-11-6-9-5-10(8-3-4-8)7-13-12(9)14-11/h5-8H,2-4H2,1H3.
What are the key properties of 5-cyclopropyl-2-ethylthieno[2,3-b]pyridine?
5-cyclopropyl-2-ethylthieno[2,3-b]pyridine has a molecular weight of 203.31 g/mol, XLogP of 3.74, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-ethylthieno[2,3-b]pyridine is sourced from PubChem (CID 171090119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).