N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide

C16H15F3N4O2 — CID 9296498

IUPACN-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide
SMILESO=C(Nc1cc(C(F)(F)F)ccc1N1CCOCC1)c1cnccn1
InChIInChI=1S/C16H15F3N4O2/c17-16(18,19)11-1-2-14(23-5-7-25-8-6-23)12(9-11)22-15(24)13-10-20-3-4-21-13/h1-4,9-10H,5-8H2,(H,22,24)
InChIKeyRZPNPQMWCQYDHI-UHFFFAOYSA-N
MW352.32 g/mol
LogP2.58
Rot. Bonds3

About N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide

N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide (PubChem CID 9296498) has the molecular formula C16H15F3N4O2 and a molecular weight of 352.32 g/mol. Its IUPAC name is N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide
PubChem CID9296498
Molecular FormulaC16H15F3N4O2
Molecular Weight352.32 g/mol
Exact Mass352.11
IUPAC NameN-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide
SMILESO=C(Nc1cc(C(F)(F)F)ccc1N1CCOCC1)c1cnccn1
InChIInChI=1S/C16H15F3N4O2/c17-16(18,19)11-1-2-14(23-5-7-25-8-6-23)12(9-11)22-15(24)13-10-20-3-4-21-13/h1-4,9-10H,5-8H2,(H,22,24)
InChIKeyRZPNPQMWCQYDHI-UHFFFAOYSA-N
XLogP2.58
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.32
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide?
The IUPAC name of N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide (CID 9296498) is N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide is O=C(Nc1cc(C(F)(F)F)ccc1N1CCOCC1)c1cnccn1.
What is the InChIKey of N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide?
The InChIKey is RZPNPQMWCQYDHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N4O2/c17-16(18,19)11-1-2-14(23-5-7-25-8-6-23)12(9-11)22-15(24)13-10-20-3-4-21-13/h1-4,9-10H,5-8H2,(H,22,24).
What are the key properties of N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide?
N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide has a molecular weight of 352.32 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide is sourced from PubChem (CID 9296498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).