N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide

C17H19N3O2 — CID 119866026

IUPACN-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide
SMILESO=C(Nc1cnccc1Oc1ccccc1)C1CCNCC1
InChIInChI=1S/C17H19N3O2/c21-17(13-6-9-18-10-7-13)20-15-12-19-11-8-16(15)22-14-4-2-1-3-5-14/h1-5,8,11-13,18H,6-7,9-10H2,(H,20,21)
InChIKeyVOQHUGYBLMIDGW-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.81
Rot. Bonds4

About N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide

N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide (PubChem CID 119866026) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide
PubChem CID119866026
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC NameN-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide
SMILESO=C(Nc1cnccc1Oc1ccccc1)C1CCNCC1
InChIInChI=1S/C17H19N3O2/c21-17(13-6-9-18-10-7-13)20-15-12-19-11-8-16(15)22-14-4-2-1-3-5-14/h1-5,8,11-13,18H,6-7,9-10H2,(H,20,21)
InChIKeyVOQHUGYBLMIDGW-UHFFFAOYSA-N
XLogP2.81
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide?
The IUPAC name of N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide (CID 119866026) is N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide?
The canonical SMILES for N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide is O=C(Nc1cnccc1Oc1ccccc1)C1CCNCC1.
What is the InChIKey of N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide?
The InChIKey is VOQHUGYBLMIDGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c21-17(13-6-9-18-10-7-13)20-15-12-19-11-8-16(15)22-14-4-2-1-3-5-14/h1-5,8,11-13,18H,6-7,9-10H2,(H,20,21).
What are the key properties of N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide?
N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide has a molecular weight of 297.36 g/mol, XLogP of 2.81, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenoxy-3-pyridinyl)piperidine-4-carboxamide is sourced from PubChem (CID 119866026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).