morpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone

C12H12N4O2S — CID 175854470

IUPACmorpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone
SMILESO=C(c1cnc(-c2cnccn2)s1)N1CCOCC1
InChIInChI=1S/C12H12N4O2S/c17-12(16-3-5-18-6-4-16)10-8-15-11(19-10)9-7-13-1-2-14-9/h1-2,7-8H,3-6H2
InChIKeyDLMXRWUWSKEETM-UHFFFAOYSA-N
MW276.32 g/mol
LogP1.07
Rot. Bonds2

About morpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone

morpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone (PubChem CID 175854470) has the molecular formula C12H12N4O2S and a molecular weight of 276.32 g/mol. Its IUPAC name is morpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone
PubChem CID175854470
Molecular FormulaC12H12N4O2S
Molecular Weight276.32 g/mol
Exact Mass276.07
IUPAC Namemorpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone
SMILESO=C(c1cnc(-c2cnccn2)s1)N1CCOCC1
InChIInChI=1S/C12H12N4O2S/c17-12(16-3-5-18-6-4-16)10-8-15-11(19-10)9-7-13-1-2-14-9/h1-2,7-8H,3-6H2
InChIKeyDLMXRWUWSKEETM-UHFFFAOYSA-N
XLogP1.07
TPSA68.21 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.32
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone?
The IUPAC name of morpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone (CID 175854470) is morpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone.
What is the SMILES notation for morpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone?
The canonical SMILES for morpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone is O=C(c1cnc(-c2cnccn2)s1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone?
The InChIKey is DLMXRWUWSKEETM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O2S/c17-12(16-3-5-18-6-4-16)10-8-15-11(19-10)9-7-13-1-2-14-9/h1-2,7-8H,3-6H2.
What are the key properties of morpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone?
morpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone has a molecular weight of 276.32 g/mol, XLogP of 1.07, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-(2-pyrazin-2-yl-1,3-thiazol-5-yl)methanone is sourced from PubChem (CID 175854470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).