N-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

C18H18F3N3O2 — CID 135126587

IUPACN-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide
SMILESO=C(Nc1ccc(O)cn1)C1CCN(c2ccc(C(F)(F)F)cc2)CC1
InChIInChI=1S/C18H18F3N3O2/c19-18(20,21)13-1-3-14(4-2-13)24-9-7-12(8-10-24)17(26)23-16-6-5-15(25)11-22-16/h1-6,11-12,25H,7-10H2,(H,22,23,26)
InChIKeyOJOPDHJUBJYKFU-UHFFFAOYSA-N
MW365.36 g/mol
LogP3.66
Rot. Bonds3

About N-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

N-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide (PubChem CID 135126587) has the molecular formula C18H18F3N3O2 and a molecular weight of 365.36 g/mol. Its IUPAC name is N-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide
PubChem CID135126587
Molecular FormulaC18H18F3N3O2
Molecular Weight365.36 g/mol
Exact Mass365.14
IUPAC NameN-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide
SMILESO=C(Nc1ccc(O)cn1)C1CCN(c2ccc(C(F)(F)F)cc2)CC1
InChIInChI=1S/C18H18F3N3O2/c19-18(20,21)13-1-3-14(4-2-13)24-9-7-12(8-10-24)17(26)23-16-6-5-15(25)11-22-16/h1-6,11-12,25H,7-10H2,(H,22,23,26)
InChIKeyOJOPDHJUBJYKFU-UHFFFAOYSA-N
XLogP3.66
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.36
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide?
The IUPAC name of N-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide (CID 135126587) is N-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide.
What is the SMILES notation for N-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide?
The canonical SMILES for N-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide is O=C(Nc1ccc(O)cn1)C1CCN(c2ccc(C(F)(F)F)cc2)CC1.
What is the InChIKey of N-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide?
The InChIKey is OJOPDHJUBJYKFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F3N3O2/c19-18(20,21)13-1-3-14(4-2-13)24-9-7-12(8-10-24)17(26)23-16-6-5-15(25)11-22-16/h1-6,11-12,25H,7-10H2,(H,22,23,26).
What are the key properties of N-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide?
N-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide has a molecular weight of 365.36 g/mol, XLogP of 3.66, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxy-2-pyridinyl)-1-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide is sourced from PubChem (CID 135126587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).