4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide

C18H17F2N3O3 — CID 122256720

IUPAC4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide
SMILESNC(=O)c1cc(OC2CCCN(C(=O)c3c(F)cccc3F)C2)ccn1
InChIInChI=1S/C18H17F2N3O3/c19-13-4-1-5-14(20)16(13)18(25)23-8-2-3-12(10-23)26-11-6-7-22-15(9-11)17(21)24/h1,4-7,9,12H,2-3,8,10H2,(H2,21,24)
InChIKeyYPJRJBUESRTPBK-UHFFFAOYSA-N
MW361.35 g/mol
LogP2.14
Rot. Bonds4

About 4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide

4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide (PubChem CID 122256720) has the molecular formula C18H17F2N3O3 and a molecular weight of 361.35 g/mol. Its IUPAC name is 4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide.

Molecular Properties

Compound Name4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide
PubChem CID122256720
Molecular FormulaC18H17F2N3O3
Molecular Weight361.35 g/mol
Exact Mass361.12
IUPAC Name4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide
SMILESNC(=O)c1cc(OC2CCCN(C(=O)c3c(F)cccc3F)C2)ccn1
InChIInChI=1S/C18H17F2N3O3/c19-13-4-1-5-14(20)16(13)18(25)23-8-2-3-12(10-23)26-11-6-7-22-15(9-11)17(21)24/h1,4-7,9,12H,2-3,8,10H2,(H2,21,24)
InChIKeyYPJRJBUESRTPBK-UHFFFAOYSA-N
XLogP2.14
TPSA85.52 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.35
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[1-(4-fluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256712
4-[1-[(2-fluorophenyl)carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide
CID 122257011
4-[1-(1,2-oxazole-5-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256598
4-[1-(4-bromobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256718
(2,6-difluorophenyl)-(3-pyrimidin-2-yloxypiperidin-1-yl)methanone
CID 122257276
4-[1-(cyclopentylcarbamoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122257046
methyl 4-[3-[(2-carbamoyl-4-pyridinyl)oxy]piperidine-1-carbonyl]benzoate
CID 122256644
4-[1-(3,3,3-trifluoropropanoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256922
4-[1-(phenylcarbamoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256998
4-[1-(2-nitrobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256727
4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256747
4-(1-butanoylpiperidin-3-yl)oxypyridine-2-carboxamide
CID 122256660

Frequently Asked Questions

What is the IUPAC name of 4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide?
The IUPAC name of 4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide (CID 122256720) is 4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide.
What is the SMILES notation for 4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide?
The canonical SMILES for 4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide is NC(=O)c1cc(OC2CCCN(C(=O)c3c(F)cccc3F)C2)ccn1.
What is the InChIKey of 4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide?
The InChIKey is YPJRJBUESRTPBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F2N3O3/c19-13-4-1-5-14(20)16(13)18(25)23-8-2-3-12(10-23)26-11-6-7-22-15(9-11)17(21)24/h1,4-7,9,12H,2-3,8,10H2,(H2,21,24).
What are the key properties of 4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide?
4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide has a molecular weight of 361.35 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide is sourced from PubChem (CID 122256720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).