4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide

C18H18F2N2O3 — CID 22145685

IUPAC4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide
SMILESCOc1cnc(C(=O)Nc2c(F)cccc2F)cc1OC1CCCC1
InChIInChI=1S/C18H18F2N2O3/c1-24-16-10-21-14(9-15(16)25-11-5-2-3-6-11)18(23)22-17-12(19)7-4-8-13(17)20/h4,7-11H,2-3,5-6H2,1H3,(H,22,23)
InChIKeyGMTLTOAAIIVKNB-UHFFFAOYSA-N
MW348.35 g/mol
LogP3.94
Rot. Bonds5

About 4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide

4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide (PubChem CID 22145685) has the molecular formula C18H18F2N2O3 and a molecular weight of 348.35 g/mol. Its IUPAC name is 4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide.

Molecular Properties

Compound Name4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide
PubChem CID22145685
Molecular FormulaC18H18F2N2O3
Molecular Weight348.35 g/mol
Exact Mass348.13
IUPAC Name4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide
SMILESCOc1cnc(C(=O)Nc2c(F)cccc2F)cc1OC1CCCC1
InChIInChI=1S/C18H18F2N2O3/c1-24-16-10-21-14(9-15(16)25-11-5-2-3-6-11)18(23)22-17-12(19)7-4-8-13(17)20/h4,7-11H,2-3,5-6H2,1H3,(H,22,23)
InChIKeyGMTLTOAAIIVKNB-UHFFFAOYSA-N
XLogP3.94
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.35
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide?
The IUPAC name of 4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide (CID 22145685) is 4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide.
What is the SMILES notation for 4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide?
The canonical SMILES for 4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide is COc1cnc(C(=O)Nc2c(F)cccc2F)cc1OC1CCCC1.
What is the InChIKey of 4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide?
The InChIKey is GMTLTOAAIIVKNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2N2O3/c1-24-16-10-21-14(9-15(16)25-11-5-2-3-6-11)18(23)22-17-12(19)7-4-8-13(17)20/h4,7-11H,2-3,5-6H2,1H3,(H,22,23).
What are the key properties of 4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide?
4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide has a molecular weight of 348.35 g/mol, XLogP of 3.94, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-N-(2,6-difluorophenyl)-5-methoxypyridine-2-carboxamide is sourced from PubChem (CID 22145685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).