N-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine

C15H14N4OS — CID 86282771

IUPACN-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
SMILESCCOc1ccc(Nc2nc(-c3ccccn3)cs2)nc1
InChIInChI=1S/C15H14N4OS/c1-2-20-11-6-7-14(17-9-11)19-15-18-13(10-21-15)12-5-3-4-8-16-12/h3-10H,2H2,1H3,(H,17,18,19)
InChIKeyDNOQGNOSRINZCM-UHFFFAOYSA-N
MW298.37 g/mol
LogP3.74
Rot. Bonds5

About N-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine

N-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine (PubChem CID 86282771) has the molecular formula C15H14N4OS and a molecular weight of 298.37 g/mol. Its IUPAC name is N-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
PubChem CID86282771
Molecular FormulaC15H14N4OS
Molecular Weight298.37 g/mol
Exact Mass298.09
IUPAC NameN-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine
SMILESCCOc1ccc(Nc2nc(-c3ccccn3)cs2)nc1
InChIInChI=1S/C15H14N4OS/c1-2-20-11-6-7-14(17-9-11)19-15-18-13(10-21-15)12-5-3-4-8-16-12/h3-10H,2H2,1H3,(H,17,18,19)
InChIKeyDNOQGNOSRINZCM-UHFFFAOYSA-N
XLogP3.74
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
The IUPAC name of N-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine (CID 86282771) is N-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for N-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine is CCOc1ccc(Nc2nc(-c3ccccn3)cs2)nc1.
What is the InChIKey of N-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
The InChIKey is DNOQGNOSRINZCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4OS/c1-2-20-11-6-7-14(17-9-11)19-15-18-13(10-21-15)12-5-3-4-8-16-12/h3-10H,2H2,1H3,(H,17,18,19).
What are the key properties of N-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine?
N-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine has a molecular weight of 298.37 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethoxy-2-pyridinyl)-4-pyridin-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 86282771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).