N-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine

C16H18N2OS — CID 83183474

IUPACN-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine
SMILESCCCNC(Cc1ccoc1)c1cnc2ccsc2c1
InChIInChI=1S/C16H18N2OS/c1-2-5-17-15(8-12-3-6-19-11-12)13-9-16-14(18-10-13)4-7-20-16/h3-4,6-7,9-11,15,17H,2,5,8H2,1H3
InChIKeyVIVVXHXPZPHFQD-UHFFFAOYSA-N
MW286.40 g/mol
LogP4.17
Rot. Bonds6

About N-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine

N-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine (PubChem CID 83183474) has the molecular formula C16H18N2OS and a molecular weight of 286.40 g/mol. Its IUPAC name is N-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine
PubChem CID83183474
Molecular FormulaC16H18N2OS
Molecular Weight286.40 g/mol
Exact Mass286.11
IUPAC NameN-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine
SMILESCCCNC(Cc1ccoc1)c1cnc2ccsc2c1
InChIInChI=1S/C16H18N2OS/c1-2-5-17-15(8-12-3-6-19-11-12)13-9-16-14(18-10-13)4-7-20-16/h3-4,6-7,9-11,15,17H,2,5,8H2,1H3
InChIKeyVIVVXHXPZPHFQD-UHFFFAOYSA-N
XLogP4.17
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(furan-2-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine
CID 83183572
N-[2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine
CID 81143134
4,4,4-trifluoro-N-propyl-1-thieno[3,2-b]pyridin-6-ylbutan-1-amine
CID 81143135
N-propyl-1-thieno[3,2-b]pyridin-6-yl-3-thiophen-2-ylpropan-1-amine
CID 81153016
N-[2-(furan-3-yl)-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine
CID 105177828
N-[1-(4-ethoxyphenyl)-2-(furan-3-yl)ethyl]propan-1-amine
CID 105029819
N-ethyl-1-thieno[3,2-b]pyridin-6-yl-2-thiophen-2-ylethanamine
CID 81144170
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-chlorothiophen-2-yl)-thieno[3,2-b]pyridin-6-ylmethyl]propan-1-amine
CID 107360052
N-[(1-ethylpyrazol-4-yl)-thieno[3,2-b]pyridin-6-ylmethyl]propan-1-amine
CID 81153035
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(furan-3-yl)ethyl]propan-1-amine
CID 105029671

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine?
The IUPAC name of N-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine (CID 83183474) is N-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine.
What is the SMILES notation for N-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine?
The canonical SMILES for N-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine is CCCNC(Cc1ccoc1)c1cnc2ccsc2c1.
What is the InChIKey of N-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine?
The InChIKey is VIVVXHXPZPHFQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2OS/c1-2-5-17-15(8-12-3-6-19-11-12)13-9-16-14(18-10-13)4-7-20-16/h3-4,6-7,9-11,15,17H,2,5,8H2,1H3.
What are the key properties of N-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine?
N-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine has a molecular weight of 286.40 g/mol, XLogP of 4.17, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-3-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine is sourced from PubChem (CID 83183474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).