4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide

C19H19F3N4O3 — CID 122257031

IUPAC4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide
SMILESNC(=O)c1cc(OC2CCCN(C(=O)Nc3ccc(C(F)(F)F)cc3)C2)ccn1
InChIInChI=1S/C19H19F3N4O3/c20-19(21,22)12-3-5-13(6-4-12)25-18(28)26-9-1-2-15(11-26)29-14-7-8-24-16(10-14)17(23)27/h3-8,10,15H,1-2,9,11H2,(H2,23,27)(H,25,28)
InChIKeyOKULSACTCIDZPN-UHFFFAOYSA-N
MW408.38 g/mol
LogP3.27
Rot. Bonds4

About 4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide

4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide (PubChem CID 122257031) has the molecular formula C19H19F3N4O3 and a molecular weight of 408.38 g/mol. Its IUPAC name is 4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide.

Molecular Properties

Compound Name4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide
PubChem CID122257031
Molecular FormulaC19H19F3N4O3
Molecular Weight408.38 g/mol
Exact Mass408.14
IUPAC Name4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide
SMILESNC(=O)c1cc(OC2CCCN(C(=O)Nc3ccc(C(F)(F)F)cc3)C2)ccn1
InChIInChI=1S/C19H19F3N4O3/c20-19(21,22)12-3-5-13(6-4-12)25-18(28)26-9-1-2-15(11-26)29-14-7-8-24-16(10-14)17(23)27/h3-8,10,15H,1-2,9,11H2,(H2,23,27)(H,25,28)
InChIKeyOKULSACTCIDZPN-UHFFFAOYSA-N
XLogP3.27
TPSA97.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.38
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[1-(phenylcarbamoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256998
3-pyridin-4-yloxy-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 122255985
4-[1-[(2-fluorophenyl)carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide
CID 122257011
4-[1-(cyclopentylcarbamoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122257046
4-[1-(3,3,3-trifluoropropanoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256922
N-[4-(trifluoromethyl)phenyl]-3-[4-(trifluoromethyl)pyrimidin-2-yl]oxypiperidine-1-carboxamide
CID 122267743
4-[1-[(2-methoxyphenyl)carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide
CID 122257006
3-(4,6-dimethylpyrimidin-2-yl)oxy-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 122258090
4-(1-butanoylpiperidin-3-yl)oxypyridine-2-carboxamide
CID 122256660
4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256655
4-[1-(4-fluorobenzoyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256712
4-[1-(1,2-oxazole-5-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide
CID 122256598

Frequently Asked Questions

What is the IUPAC name of 4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide?
The IUPAC name of 4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide (CID 122257031) is 4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide.
What is the SMILES notation for 4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide?
The canonical SMILES for 4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide is NC(=O)c1cc(OC2CCCN(C(=O)Nc3ccc(C(F)(F)F)cc3)C2)ccn1.
What is the InChIKey of 4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide?
The InChIKey is OKULSACTCIDZPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F3N4O3/c20-19(21,22)12-3-5-13(6-4-12)25-18(28)26-9-1-2-15(11-26)29-14-7-8-24-16(10-14)17(23)27/h3-8,10,15H,1-2,9,11H2,(H2,23,27)(H,25,28).
What are the key properties of 4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide?
4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide has a molecular weight of 408.38 g/mol, XLogP of 3.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[[4-(trifluoromethyl)phenyl]carbamoyl]piperidin-3-yl]oxypyridine-2-carboxamide is sourced from PubChem (CID 122257031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).