N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide

C15H11FN4O2S — CID 118707828

IUPACN-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide
SMILESCc1cc(C(=O)Nc2cncc(Oc3cncc(F)c3)n2)cs1
InChIInChI=1S/C15H11FN4O2S/c1-9-2-10(8-23-9)15(21)20-13-6-18-7-14(19-13)22-12-3-11(16)4-17-5-12/h2-8H,1H3,(H,19,20,21)
InChIKeyGCXQIDZJABHAKI-UHFFFAOYSA-N
MW330.34 g/mol
LogP3.43
Rot. Bonds4

About N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide

N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide (PubChem CID 118707828) has the molecular formula C15H11FN4O2S and a molecular weight of 330.34 g/mol. Its IUPAC name is N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide.

Molecular Properties

Compound NameN-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide
PubChem CID118707828
Molecular FormulaC15H11FN4O2S
Molecular Weight330.34 g/mol
Exact Mass330.06
IUPAC NameN-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide
SMILESCc1cc(C(=O)Nc2cncc(Oc3cncc(F)c3)n2)cs1
InChIInChI=1S/C15H11FN4O2S/c1-9-2-10(8-23-9)15(21)20-13-6-18-7-14(19-13)22-12-3-11(16)4-17-5-12/h2-8H,1H3,(H,19,20,21)
InChIKeyGCXQIDZJABHAKI-UHFFFAOYSA-N
XLogP3.43
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.34
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide?
The IUPAC name of N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide (CID 118707828) is N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide.
What is the SMILES notation for N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide?
The canonical SMILES for N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide is Cc1cc(C(=O)Nc2cncc(Oc3cncc(F)c3)n2)cs1.
What is the InChIKey of N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide?
The InChIKey is GCXQIDZJABHAKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN4O2S/c1-9-2-10(8-23-9)15(21)20-13-6-18-7-14(19-13)22-12-3-11(16)4-17-5-12/h2-8H,1H3,(H,19,20,21).
What are the key properties of N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide?
N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide has a molecular weight of 330.34 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide is sourced from PubChem (CID 118707828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).