N-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide

C15H16F3N5O2 — CID 67674922

IUPACN-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide
SMILESCn1nc(C(F)(F)F)cc1Oc1cncc(C(=O)NC2CCCC2)n1
InChIInChI=1S/C15H16F3N5O2/c1-23-13(6-11(22-23)15(16,17)18)25-12-8-19-7-10(21-12)14(24)20-9-4-2-3-5-9/h6-9H,2-5H2,1H3,(H,20,24)
InChIKeyKBDQJPOPJIUYPQ-UHFFFAOYSA-N
MW355.32 g/mol
LogP2.69
Rot. Bonds4

About N-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide

N-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide (PubChem CID 67674922) has the molecular formula C15H16F3N5O2 and a molecular weight of 355.32 g/mol. Its IUPAC name is N-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide
PubChem CID67674922
Molecular FormulaC15H16F3N5O2
Molecular Weight355.32 g/mol
Exact Mass355.13
IUPAC NameN-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide
SMILESCn1nc(C(F)(F)F)cc1Oc1cncc(C(=O)NC2CCCC2)n1
InChIInChI=1S/C15H16F3N5O2/c1-23-13(6-11(22-23)15(16,17)18)25-12-8-19-7-10(21-12)14(24)20-9-4-2-3-5-9/h6-9H,2-5H2,1H3,(H,20,24)
InChIKeyKBDQJPOPJIUYPQ-UHFFFAOYSA-N
XLogP2.69
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.32
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide?
The IUPAC name of N-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide (CID 67674922) is N-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide is Cn1nc(C(F)(F)F)cc1Oc1cncc(C(=O)NC2CCCC2)n1.
What is the InChIKey of N-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide?
The InChIKey is KBDQJPOPJIUYPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F3N5O2/c1-23-13(6-11(22-23)15(16,17)18)25-12-8-19-7-10(21-12)14(24)20-9-4-2-3-5-9/h6-9H,2-5H2,1H3,(H,20,24).
What are the key properties of N-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide?
N-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide has a molecular weight of 355.32 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyrazine-2-carboxamide is sourced from PubChem (CID 67674922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).