4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide

C17H17ClFN3O2 — CID 71798962

IUPAC4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide
SMILESO=C(Nc1ccccc1F)N1CCC(Oc2ccc(Cl)cn2)CC1
InChIInChI=1S/C17H17ClFN3O2/c18-12-5-6-16(20-11-12)24-13-7-9-22(10-8-13)17(23)21-15-4-2-1-3-14(15)19/h1-6,11,13H,7-10H2,(H,21,23)
InChIKeyLEZVRPTYVURJKR-UHFFFAOYSA-N
MW349.79 g/mol
LogP3.95
Rot. Bonds3

About 4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide

4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide (PubChem CID 71798962) has the molecular formula C17H17ClFN3O2 and a molecular weight of 349.79 g/mol. Its IUPAC name is 4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide
PubChem CID71798962
Molecular FormulaC17H17ClFN3O2
Molecular Weight349.79 g/mol
Exact Mass349.10
IUPAC Name4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide
SMILESO=C(Nc1ccccc1F)N1CCC(Oc2ccc(Cl)cn2)CC1
InChIInChI=1S/C17H17ClFN3O2/c18-12-5-6-16(20-11-12)24-13-7-9-22(10-8-13)17(23)21-15-4-2-1-3-14(15)19/h1-6,11,13H,7-10H2,(H,21,23)
InChIKeyLEZVRPTYVURJKR-UHFFFAOYSA-N
XLogP3.95
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.79
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide?
The IUPAC name of 4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide (CID 71798962) is 4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide?
The canonical SMILES for 4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide is O=C(Nc1ccccc1F)N1CCC(Oc2ccc(Cl)cn2)CC1.
What is the InChIKey of 4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide?
The InChIKey is LEZVRPTYVURJKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClFN3O2/c18-12-5-6-16(20-11-12)24-13-7-9-22(10-8-13)17(23)21-15-4-2-1-3-14(15)19/h1-6,11,13H,7-10H2,(H,21,23).
What are the key properties of 4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide?
4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide has a molecular weight of 349.79 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-chloro-2-pyridinyl)oxy]-N-(2-fluorophenyl)piperidine-1-carboxamide is sourced from PubChem (CID 71798962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).