5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine

C11H10N2OS — CID 114746396

IUPAC5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine
SMILESNc1ncc(-c2cccc3c2OCC3)s1
InChIInChI=1S/C11H10N2OS/c12-11-13-6-9(15-11)8-3-1-2-7-4-5-14-10(7)8/h1-3,6H,4-5H2,(H2,12,13)
InChIKeyWIPJBGAPUTWARY-UHFFFAOYSA-N
MW218.28 g/mol
LogP2.33
Rot. Bonds1

About 5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine

5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine (PubChem CID 114746396) has the molecular formula C11H10N2OS and a molecular weight of 218.28 g/mol. Its IUPAC name is 5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine
PubChem CID114746396
Molecular FormulaC11H10N2OS
Molecular Weight218.28 g/mol
Exact Mass218.05
IUPAC Name5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine
SMILESNc1ncc(-c2cccc3c2OCC3)s1
InChIInChI=1S/C11H10N2OS/c12-11-13-6-9(15-11)8-3-1-2-7-4-5-14-10(7)8/h1-3,6H,4-5H2,(H2,12,13)
InChIKeyWIPJBGAPUTWARY-UHFFFAOYSA-N
XLogP2.33
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.28
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2,3-dihydro-1-benzofuran-7-yl)-1H-pyrazol-3-amine
CID 117290116
2-(2,3-dihydro-1-benzofuran-7-yl)pyridin-3-amine
CID 114746394
6-(2,3-dihydro-1-benzofuran-7-yl)-5-propan-2-ylpyrimidin-4-amine
CID 114747278
5-(2,3-dihydro-1-benzofuran-7-yl)-N-propan-2-ylthiophene-2-carboxamide
CID 122566939
5-naphthalen-1-yl-1,3-thiazol-2-amine
CID 17015170
4-bromo-5-(2,3-dihydro-1-benzofuran-7-yl)pyrimidine
CID 105371643
2,3-dihydro-1-benzofuran-7-amine;hydrobromide
CID 168986288
5-(3,4-dihydro-2H-chromen-8-yl)-1,2-oxazol-3-amine
CID 117308014
8-(2,3-dihydro-1-benzofuran-7-yl)-2-methylquinazoline
CID 145234099
7-(4-methylphenyl)-2,3-dihydro-1-benzofuran
CID 23543625
[2-(2,3-dihydro-1-benzofuran-7-yl)-4-pyridinyl]hydrazine
CID 102825373
6-(2,3-dihydro-1-benzofuran-7-yl)-5-nitropyrimidin-4-amine
CID 114747242

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine (CID 114746396) is 5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine is Nc1ncc(-c2cccc3c2OCC3)s1.
What is the InChIKey of 5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine?
The InChIKey is WIPJBGAPUTWARY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2OS/c12-11-13-6-9(15-11)8-3-1-2-7-4-5-14-10(7)8/h1-3,6H,4-5H2,(H2,12,13).
What are the key properties of 5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine?
5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine has a molecular weight of 218.28 g/mol, XLogP of 2.33, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dihydro-1-benzofuran-7-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 114746396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).