1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine

C12H11N3OS — CID 82384996

IUPAC1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine
SMILESNC(Cc1cncs1)c1cc2cccnc2o1
InChIInChI=1S/C12H11N3OS/c13-10(5-9-6-14-7-17-9)11-4-8-2-1-3-15-12(8)16-11/h1-4,6-7,10H,5,13H2
InChIKeyMFTWIQAVRPLVJZ-UHFFFAOYSA-N
MW245.31 g/mol
LogP2.53
Rot. Bonds3

About 1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine

1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine (PubChem CID 82384996) has the molecular formula C12H11N3OS and a molecular weight of 245.31 g/mol. Its IUPAC name is 1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine.

Molecular Properties

Compound Name1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine
PubChem CID82384996
Molecular FormulaC12H11N3OS
Molecular Weight245.31 g/mol
Exact Mass245.06
IUPAC Name1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine
SMILESNC(Cc1cncs1)c1cc2cccnc2o1
InChIInChI=1S/C12H11N3OS/c13-10(5-9-6-14-7-17-9)11-4-8-2-1-3-15-12(8)16-11/h1-4,6-7,10H,5,13H2
InChIKeyMFTWIQAVRPLVJZ-UHFFFAOYSA-N
XLogP2.53
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.31
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine?
The IUPAC name of 1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine (CID 82384996) is 1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine.
What is the SMILES notation for 1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine?
The canonical SMILES for 1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine is NC(Cc1cncs1)c1cc2cccnc2o1.
What is the InChIKey of 1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine?
The InChIKey is MFTWIQAVRPLVJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3OS/c13-10(5-9-6-14-7-17-9)11-4-8-2-1-3-15-12(8)16-11/h1-4,6-7,10H,5,13H2.
What are the key properties of 1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine?
1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine has a molecular weight of 245.31 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-furo[2,3-b]pyridin-2-yl-2-(1,3-thiazol-5-yl)ethanamine is sourced from PubChem (CID 82384996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).