N-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide

C16H16FN3O3 — CID 118613145

IUPACN-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide
SMILESCc1cc(O[C@@H]2CCOC2)cc(C(=O)Nc2ccc(F)cn2)n1
InChIInChI=1S/C16H16FN3O3/c1-10-6-13(23-12-4-5-22-9-12)7-14(19-10)16(21)20-15-3-2-11(17)8-18-15/h2-3,6-8,12H,4-5,9H2,1H3,(H,18,20,21)/t12-/m1/s1
InChIKeyZLZMPUQDCRIDEN-GFCCVEGCSA-N
MW317.32 g/mol
LogP2.34
Rot. Bonds4

About N-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide

N-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide (PubChem CID 118613145) has the molecular formula C16H16FN3O3 and a molecular weight of 317.32 g/mol. Its IUPAC name is N-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide
PubChem CID118613145
Molecular FormulaC16H16FN3O3
Molecular Weight317.32 g/mol
Exact Mass317.12
IUPAC NameN-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide
SMILESCc1cc(O[C@@H]2CCOC2)cc(C(=O)Nc2ccc(F)cn2)n1
InChIInChI=1S/C16H16FN3O3/c1-10-6-13(23-12-4-5-22-9-12)7-14(19-10)16(21)20-15-3-2-11(17)8-18-15/h2-3,6-8,12H,4-5,9H2,1H3,(H,18,20,21)/t12-/m1/s1
InChIKeyZLZMPUQDCRIDEN-GFCCVEGCSA-N
XLogP2.34
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.32
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide?
The IUPAC name of N-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide (CID 118613145) is N-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide.
What is the SMILES notation for N-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide?
The canonical SMILES for N-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide is Cc1cc(O[C@@H]2CCOC2)cc(C(=O)Nc2ccc(F)cn2)n1.
What is the InChIKey of N-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide?
The InChIKey is ZLZMPUQDCRIDEN-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H16FN3O3/c1-10-6-13(23-12-4-5-22-9-12)7-14(19-10)16(21)20-15-3-2-11(17)8-18-15/h2-3,6-8,12H,4-5,9H2,1H3,(H,18,20,21)/t12-/m1/s1.
What are the key properties of N-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide?
N-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide has a molecular weight of 317.32 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-pyridinyl)-6-methyl-4-[(3R)-oxolan-3-yl]oxypyridine-2-carboxamide is sourced from PubChem (CID 118613145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).