N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine

C15H14FN3S — CID 81144068

IUPACN-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine
SMILESCCNC(c1cncc(F)c1)c1cnc2ccsc2c1
InChIInChI=1S/C15H14FN3S/c1-2-18-15(10-5-12(16)9-17-7-10)11-6-14-13(19-8-11)3-4-20-14/h3-9,15,18H,2H2,1H3
InChIKeyFKOSJWZMIWKTNV-UHFFFAOYSA-N
MW287.36 g/mol
LogP3.53
Rot. Bonds4

About N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine

N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine (PubChem CID 81144068) has the molecular formula C15H14FN3S and a molecular weight of 287.36 g/mol. Its IUPAC name is N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine.

Molecular Properties

Compound NameN-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine
PubChem CID81144068
Molecular FormulaC15H14FN3S
Molecular Weight287.36 g/mol
Exact Mass287.09
IUPAC NameN-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine
SMILESCCNC(c1cncc(F)c1)c1cnc2ccsc2c1
InChIInChI=1S/C15H14FN3S/c1-2-18-15(10-5-12(16)9-17-7-10)11-6-14-13(19-8-11)3-4-20-14/h3-9,15,18H,2H2,1H3
InChIKeyFKOSJWZMIWKTNV-UHFFFAOYSA-N
XLogP3.53
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-bromothiophen-2-yl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine
CID 81143315
N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine
CID 54967779
3-[ethylamino(thieno[3,2-b]pyridin-6-yl)methyl]pyridin-4-amine
CID 81143213
N-[(2,5-dimethylphenyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine
CID 81153511
N-ethyl-3-methyl-1-thieno[3,2-b]pyridin-6-ylbutan-1-amine
CID 81143603
N-[(4-chloro-1-methylpyrazol-5-yl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine
CID 114659039
N-[thieno[3,2-b]pyridin-6-yl(thiophen-3-yl)methyl]propan-1-amine
CID 81143136
N-ethyl-2-(1,3-thiazol-5-yl)-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 112643482
N-[(3-chlorophenyl)-(5-fluoro-3-pyridinyl)methyl]ethanamine
CID 54967436
N-ethyl-2-propoxy-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 81143217
N-ethyl-3-methylidene-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine
CID 81144073
N-[cycloheptyl(thieno[3,2-b]pyridin-6-yl)methyl]ethanamine
CID 82931928

Frequently Asked Questions

What is the IUPAC name of N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine?
The IUPAC name of N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine (CID 81144068) is N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine.
What is the SMILES notation for N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine?
The canonical SMILES for N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine is CCNC(c1cncc(F)c1)c1cnc2ccsc2c1.
What is the InChIKey of N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine?
The InChIKey is FKOSJWZMIWKTNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3S/c1-2-18-15(10-5-12(16)9-17-7-10)11-6-14-13(19-8-11)3-4-20-14/h3-9,15,18H,2H2,1H3.
What are the key properties of N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine?
N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine has a molecular weight of 287.36 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine is sourced from PubChem (CID 81144068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).