4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide

C19H21N3O4 — CID 122256747

IUPAC4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide
SMILESNC(=O)c1cc(OC2CCCN(C(=O)COc3ccccc3)C2)ccn1
InChIInChI=1S/C19H21N3O4/c20-19(24)17-11-15(8-9-21-17)26-16-7-4-10-22(12-16)18(23)13-25-14-5-2-1-3-6-14/h1-3,5-6,8-9,11,16H,4,7,10,12-13H2,(H2,20,24)
InChIKeyBSNXQPBTLVMINL-UHFFFAOYSA-N
MW355.39 g/mol
LogP1.63
Rot. Bonds6

About 4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide

4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide (PubChem CID 122256747) has the molecular formula C19H21N3O4 and a molecular weight of 355.39 g/mol. Its IUPAC name is 4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide.

Molecular Properties

Compound Name4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide
PubChem CID122256747
Molecular FormulaC19H21N3O4
Molecular Weight355.39 g/mol
Exact Mass355.15
IUPAC Name4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide
SMILESNC(=O)c1cc(OC2CCCN(C(=O)COc3ccccc3)C2)ccn1
InChIInChI=1S/C19H21N3O4/c20-19(24)17-11-15(8-9-21-17)26-16-7-4-10-22(12-16)18(23)13-25-14-5-2-1-3-6-14/h1-3,5-6,8-9,11,16H,4,7,10,12-13H2,(H2,20,24)
InChIKeyBSNXQPBTLVMINL-UHFFFAOYSA-N
XLogP1.63
TPSA94.75 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[1-[2-(3-methylphenoxy)acetyl]piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256758
4-(1-butanoylpiperidin-3-yl)oxypyridine-2-carboxamide
CID 122256660
4-[1-(phenylcarbamoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256998
4-[1-(3,3,3-trifluoropropanoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256922
4-[1-(cyclopentylcarbamoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122257046
4-[1-[4-(4-chlorophenyl)-4-oxobutanoyl]piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256640
4-[1-(2,6-difluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256720
4-[1-[(2-fluorophenyl)carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide
CID 122257011
4-[1-(2-chloropropanoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256686
2-pyridin-3-yloxy-1-(3-pyridin-4-yloxypiperidin-1-yl)ethanone
CID 122255663
4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256655
4-[1-(4-bromobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256718

Frequently Asked Questions

What is the IUPAC name of 4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide?
The IUPAC name of 4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide (CID 122256747) is 4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide.
What is the SMILES notation for 4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide?
The canonical SMILES for 4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide is NC(=O)c1cc(OC2CCCN(C(=O)COc3ccccc3)C2)ccn1.
What is the InChIKey of 4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide?
The InChIKey is BSNXQPBTLVMINL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O4/c20-19(24)17-11-15(8-9-21-17)26-16-7-4-10-22(12-16)18(23)13-25-14-5-2-1-3-6-14/h1-3,5-6,8-9,11,16H,4,7,10,12-13H2,(H2,20,24).
What are the key properties of 4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide?
4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide has a molecular weight of 355.39 g/mol, XLogP of 1.63, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(2-phenoxyacetyl)piperidin-3-yl]oxypyridine-2-carboxamide is sourced from PubChem (CID 122256747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).