N-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide

C19H22FN3O2 — CID 53150983

IUPACN-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)N1CCC(CCOc2ccncc2)CC1
InChIInChI=1S/C19H22FN3O2/c20-16-2-1-3-17(14-16)22-19(24)23-11-6-15(7-12-23)8-13-25-18-4-9-21-10-5-18/h1-5,9-10,14-15H,6-8,11-13H2,(H,22,24)
InChIKeyKQKNIDYLMNVAMV-UHFFFAOYSA-N
MW343.40 g/mol
LogP3.93
Rot. Bonds5

About N-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide

N-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide (PubChem CID 53150983) has the molecular formula C19H22FN3O2 and a molecular weight of 343.40 g/mol. Its IUPAC name is N-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide
PubChem CID53150983
Molecular FormulaC19H22FN3O2
Molecular Weight343.40 g/mol
Exact Mass343.17
IUPAC NameN-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)N1CCC(CCOc2ccncc2)CC1
InChIInChI=1S/C19H22FN3O2/c20-16-2-1-3-17(14-16)22-19(24)23-11-6-15(7-12-23)8-13-25-18-4-9-21-10-5-18/h1-5,9-10,14-15H,6-8,11-13H2,(H,22,24)
InChIKeyKQKNIDYLMNVAMV-UHFFFAOYSA-N
XLogP3.93
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.40
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-N'-(4-ethoxyphenyl)-N-(1-pyridin-4-ylethyl)urea
CID 3244432
N-(3-fluorophenyl)-4-(3-pyridin-3-ylphenoxy)piperidine-1-carboxamide
CID 24733734
Methyl 4-[3-fluoro-5-[(6-methyl-3-pyridinyl)carbamoylamino]phenoxy]piperidine-1-carboxylate
CID 56673897
N-[(1S,2R)-2-phenylcyclopropyl]-4-pyridin-4-yloxypiperidine-1-carboxamide
CID 76332320
1-[(6-Fluoro-3-pyridinyl)methyl]-1-(1-methylpiperidin-4-yl)-3-[[4-(2-methylpropoxy)phenyl]methyl]urea
CID 168274667
1-[(4-Fluorophenyl)methyl]-1-(1-methylpiperidin-4-yl)-3-[[6-(2-methylpropoxy)-3-pyridinyl]methyl]urea
CID 169490286
(A)-3-((4-(Aminomethyl)pyridin-2-yl)oxy)-N-phenylpiperidine-1-carboxamide trifluoroacetate
CID 122516207
4-(pyridin-4-ylmethyl)-N-[3-(trifluoromethoxy)phenyl]piperazine-1-carboxamide
CID 45890676
2-(3-Fluorophenyl)-1-{4-[2-(4-pyridyloxy)ethyl]piperidino}-1-ethanone
CID 53150941
2-(2-Fluorophenyl)-1-(4-{2-[(pyridin-4-yl)oxy]ethyl}piperidin-1-yl)ethan-1-one
CID 53150944
N-(4-Fluorophenyl)-4-[2-(pyridin-4-yloxy)ethyl]piperidine-1-carboxamide
CID 53150966
N-[(4-Fluorophenyl)methyl]-4-[2-(pyridin-4-yloxy)ethyl]piperidine-1-carboxamide
CID 53150982

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide (CID 53150983) is N-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide is O=C(Nc1cccc(F)c1)N1CCC(CCOc2ccncc2)CC1.
What is the InChIKey of N-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide?
The InChIKey is KQKNIDYLMNVAMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3O2/c20-16-2-1-3-17(14-16)22-19(24)23-11-6-15(7-12-23)8-13-25-18-4-9-21-10-5-18/h1-5,9-10,14-15H,6-8,11-13H2,(H,22,24).
What are the key properties of N-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide?
N-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide has a molecular weight of 343.40 g/mol, XLogP of 3.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide is sourced from PubChem (CID 53150983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).