4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide

C19H19F3N2O3 — CID 22145691

IUPAC4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
SMILESCOc1cnc(C(=O)Nc2ccccc2C(F)(F)F)cc1OC1CCCC1
InChIInChI=1S/C19H19F3N2O3/c1-26-17-11-23-15(10-16(17)27-12-6-2-3-7-12)18(25)24-14-9-5-4-8-13(14)19(20,21)22/h4-5,8-12H,2-3,6-7H2,1H3,(H,24,25)
InChIKeyXHRQDKZQELZQQL-UHFFFAOYSA-N
MW380.37 g/mol
LogP4.68
Rot. Bonds5

About 4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide

4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide (PubChem CID 22145691) has the molecular formula C19H19F3N2O3 and a molecular weight of 380.37 g/mol. Its IUPAC name is 4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
PubChem CID22145691
Molecular FormulaC19H19F3N2O3
Molecular Weight380.37 g/mol
Exact Mass380.13
IUPAC Name4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
SMILESCOc1cnc(C(=O)Nc2ccccc2C(F)(F)F)cc1OC1CCCC1
InChIInChI=1S/C19H19F3N2O3/c1-26-17-11-23-15(10-16(17)27-12-6-2-3-7-12)18(25)24-14-9-5-4-8-13(14)19(20,21)22/h4-5,8-12H,2-3,6-7H2,1H3,(H,24,25)
InChIKeyXHRQDKZQELZQQL-UHFFFAOYSA-N
XLogP4.68
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.37
LogP ≤ 54.68
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-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
The IUPAC name of 4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide (CID 22145691) is 4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for 4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide is COc1cnc(C(=O)Nc2ccccc2C(F)(F)F)cc1OC1CCCC1.
What is the InChIKey of 4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
The InChIKey is XHRQDKZQELZQQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F3N2O3/c1-26-17-11-23-15(10-16(17)27-12-6-2-3-7-12)18(25)24-14-9-5-4-8-13(14)19(20,21)22/h4-5,8-12H,2-3,6-7H2,1H3,(H,24,25).
What are the key properties of 4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
4-cyclopentyloxy-5-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide has a molecular weight of 380.37 g/mol, XLogP of 4.68, 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-(trifluoromethyl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 22145691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).