6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide

C21H26FN3O2 — CID 53464528

IUPAC6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide
SMILESCCCN1CCCC(CNC(=O)c2cccc(Oc3ccc(F)cc3)n2)C1
InChIInChI=1S/C21H26FN3O2/c1-2-12-25-13-4-5-16(15-25)14-23-21(26)19-6-3-7-20(24-19)27-18-10-8-17(22)9-11-18/h3,6-11,16H,2,4-5,12-15H2,1H3,(H,23,26)
InChIKeyPQKPBEUQJLGNGB-UHFFFAOYSA-N
MW371.46 g/mol
LogP3.86
Rot. Bonds7

About 6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide

6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide (PubChem CID 53464528) has the molecular formula C21H26FN3O2 and a molecular weight of 371.46 g/mol. Its IUPAC name is 6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide
PubChem CID53464528
Molecular FormulaC21H26FN3O2
Molecular Weight371.46 g/mol
Exact Mass371.20
IUPAC Name6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide
SMILESCCCN1CCCC(CNC(=O)c2cccc(Oc3ccc(F)cc3)n2)C1
InChIInChI=1S/C21H26FN3O2/c1-2-12-25-13-4-5-16(15-25)14-23-21(26)19-6-3-7-20(24-19)27-18-10-8-17(22)9-11-18/h3,6-11,16H,2,4-5,12-15H2,1H3,(H,23,26)
InChIKeyPQKPBEUQJLGNGB-UHFFFAOYSA-N
XLogP3.86
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.46
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Picolinafen
CID 3294375
Pyridine amide, 12
CID 44236998
6-(4-(2-(Benzylamino)ethyl)phenoxy)picolinamide
CID 44434931
Pyridine amide, 29
CID 44237004
6-butoxy-N-(2-(4-((2,3-dihydrobenzo[b][1,4]dioxin-2-yl)methyl)-1,4-diazepan-1-yl)ethyl)picolinamide
CID 44579230
N,N-Diethyl-5-(spiro[chromene-2,4''-piperidine]-4-yl)picolinamide
CID 11211122
6-[4-(4-Fluorophenoxy)phenyl]-N-[2-(1-piperidinyl)ethyl]-2-pyridinecarboxamide
CID 11247128
N-[2-(dimethylamino)ethyl]-6-[4-(4-fluorophenoxy)phenyl]-4-methoxypyridine-2-carboxamide
CID 11475352
N-[4-[4-(3-methoxyphenyl)piperazin-1-yl]butyl]pyridine-2-carboxamide
CID 11501537
N-[4-[4-(3-methoxyphenyl)piperazin-1-yl]butyl]-6-methylpyridine-2-carboxamide
CID 60204112
N-[4-[[3-[5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]methylidene]cyclohexyl]pyridine-2-carboxamide
CID 71543951
2-[4-(4-fluorophenoxy)phenyl]-6-methyl-N-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]pyridine-4-carboxamide
CID 71566103

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide?
The IUPAC name of 6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide (CID 53464528) is 6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide is CCCN1CCCC(CNC(=O)c2cccc(Oc3ccc(F)cc3)n2)C1.
What is the InChIKey of 6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide?
The InChIKey is PQKPBEUQJLGNGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26FN3O2/c1-2-12-25-13-4-5-16(15-25)14-23-21(26)19-6-3-7-20(24-19)27-18-10-8-17(22)9-11-18/h3,6-11,16H,2,4-5,12-15H2,1H3,(H,23,26).
What are the key properties of 6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide?
6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide has a molecular weight of 371.46 g/mol, XLogP of 3.86, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenoxy)-N-[(1-propylpiperidin-3-yl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 53464528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).