4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine

C12H9N3OS — CID 72720213

IUPAC4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine
SMILESc1cncc(Nc2nc(-c3ccoc3)cs2)c1
InChIInChI=1S/C12H9N3OS/c1-2-10(6-13-4-1)14-12-15-11(8-17-12)9-3-5-16-7-9/h1-8H,(H,14,15)
InChIKeyWEVICJVQAOFBDJ-UHFFFAOYSA-N
MW243.29 g/mol
LogP3.54
Rot. Bonds3

About 4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine

4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine (PubChem CID 72720213) has the molecular formula C12H9N3OS and a molecular weight of 243.29 g/mol. Its IUPAC name is 4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine
PubChem CID72720213
Molecular FormulaC12H9N3OS
Molecular Weight243.29 g/mol
Exact Mass243.05
IUPAC Name4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine
SMILESc1cncc(Nc2nc(-c3ccoc3)cs2)c1
InChIInChI=1S/C12H9N3OS/c1-2-10(6-13-4-1)14-12-15-11(8-17-12)9-3-5-16-7-9/h1-8H,(H,14,15)
InChIKeyWEVICJVQAOFBDJ-UHFFFAOYSA-N
XLogP3.54
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.29
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(furan-2-ylmethyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 883342
(E)-3-(furan-2-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)prop-2-enamide
CID 2406282
N-(2-furylmethyl)-4-(4-pyridinyl)-1,3-thiazol-2-amine
CID 2901964
5-(furan-2-yl)-N-methyl-3-(thiazol-5-yl)-3H-pyrido[2,3-e][1,4]diazepin-2-amine
CID 135400824
1-(Furan-2-ylmethyl)-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)urea
CID 87406734
N-(4-pyridin-4-yl-1,3-thiazol-2-yl)furan-2-carboxamide
CID 2081288
3-(5-phenylfuran-2-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)propanamide
CID 16366041
N-[4-(2-pyridyl)thiazol-2-yl]furan-3-carboxamide
CID 41164443
N-(5-methoxy-[1,3]thiazolo[5,4-b]pyridin-2-yl)pyridine-4-carboxamide
CID 56592907
4-[[4-(furan-3-ylmethyl)-3,5-dihydro-2H-pyrido[2,3-e][1,4]diazepin-1-yl]methyl]-2-methyl-1,3-thiazole
CID 97520922
5-(furan-3-yl)-3-(thiophen-2-ylmethyl)-1H-imidazo[4,5-b]pyrazin-2-one
CID 172433690
3-(furan-3-yl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine
CID 172433869

Frequently Asked Questions

What is the IUPAC name of 4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine?
The IUPAC name of 4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine (CID 72720213) is 4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine is c1cncc(Nc2nc(-c3ccoc3)cs2)c1.
What is the InChIKey of 4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine?
The InChIKey is WEVICJVQAOFBDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3OS/c1-2-10(6-13-4-1)14-12-15-11(8-17-12)9-3-5-16-7-9/h1-8H,(H,14,15).
What are the key properties of 4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine?
4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine has a molecular weight of 243.29 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-3-yl)-N-pyridin-3-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 72720213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).