4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide

C18H17F3N2O3 — CID 22145756

IUPAC4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide
SMILESCOc1cnc(C(=O)Nc2c(F)cc(F)cc2F)cc1OC1CCCC1
InChIInChI=1S/C18H17F3N2O3/c1-25-16-9-22-14(8-15(16)26-11-4-2-3-5-11)18(24)23-17-12(20)6-10(19)7-13(17)21/h6-9,11H,2-5H2,1H3,(H,23,24)
InChIKeyMYGYXLDKIMTNQD-UHFFFAOYSA-N
MW366.34 g/mol
LogP4.08
Rot. Bonds5

About 4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide

4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide (PubChem CID 22145756) has the molecular formula C18H17F3N2O3 and a molecular weight of 366.34 g/mol. Its IUPAC name is 4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide
PubChem CID22145756
Molecular FormulaC18H17F3N2O3
Molecular Weight366.34 g/mol
Exact Mass366.12
IUPAC Name4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide
SMILESCOc1cnc(C(=O)Nc2c(F)cc(F)cc2F)cc1OC1CCCC1
InChIInChI=1S/C18H17F3N2O3/c1-25-16-9-22-14(8-15(16)26-11-4-2-3-5-11)18(24)23-17-12(20)6-10(19)7-13(17)21/h6-9,11H,2-5H2,1H3,(H,23,24)
InChIKeyMYGYXLDKIMTNQD-UHFFFAOYSA-N
XLogP4.08
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.34
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide?
The IUPAC name of 4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide (CID 22145756) is 4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide is COc1cnc(C(=O)Nc2c(F)cc(F)cc2F)cc1OC1CCCC1.
What is the InChIKey of 4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide?
The InChIKey is MYGYXLDKIMTNQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F3N2O3/c1-25-16-9-22-14(8-15(16)26-11-4-2-3-5-11)18(24)23-17-12(20)6-10(19)7-13(17)21/h6-9,11H,2-5H2,1H3,(H,23,24).
What are the key properties of 4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide?
4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide has a molecular weight of 366.34 g/mol, XLogP of 4.08, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-5-methoxy-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 22145756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).