N-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide

C20H20N4O2 — CID 86832440

IUPACN-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1cccc(N2CCCCC2)c1)c1cc(-c2cccnc2)on1
InChIInChI=1S/C20H20N4O2/c25-20(18-13-19(26-23-18)15-6-5-9-21-14-15)22-16-7-4-8-17(12-16)24-10-2-1-3-11-24/h4-9,12-14H,1-3,10-11H2,(H,22,25)
InChIKeyHMHLORUTLDJRNK-UHFFFAOYSA-N
MW348.41 g/mol
LogP3.98
Rot. Bonds4

About N-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide

N-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide (PubChem CID 86832440) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is N-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
PubChem CID86832440
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC NameN-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1cccc(N2CCCCC2)c1)c1cc(-c2cccnc2)on1
InChIInChI=1S/C20H20N4O2/c25-20(18-13-19(26-23-18)15-6-5-9-21-14-15)22-16-7-4-8-17(12-16)24-10-2-1-3-11-24/h4-9,12-14H,1-3,10-11H2,(H,22,25)
InChIKeyHMHLORUTLDJRNK-UHFFFAOYSA-N
XLogP3.98
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)amino]phenyl]-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 122295737
N-(4-anilinophenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 47048043
N-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 56503276
3-chloro-N-(3-pyrrolidin-1-ylphenyl)pyridine-4-carboxamide
CID 66462445
N-[3-(1,1-dioxothiazinan-2-yl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 110312981
ethyl 3-[(5-pyridin-3-yl-1,2-oxazole-3-carbonyl)amino]benzoate
CID 53051791
5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide
CID 110618704
N-[3-(dimethylamino)-4-methylphenyl]-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 53051794
N-[3-(oxan-4-ylsulfinylmethyl)phenyl]-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 86956720
3-(3-piperidin-1-ylphenyl)pyridine
CID 166240155
N-(2-chloro-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 17253103
(5-pyridin-3-yl-1,2-oxazol-3-yl)-[4-(6-pyrrolidin-1-ylpyridazin-3-yl)piperazin-1-yl]methanone
CID 122334447

Frequently Asked Questions

What is the IUPAC name of N-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide (CID 86832440) is N-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide is O=C(Nc1cccc(N2CCCCC2)c1)c1cc(-c2cccnc2)on1.
What is the InChIKey of N-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide?
The InChIKey is HMHLORUTLDJRNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2/c25-20(18-13-19(26-23-18)15-6-5-9-21-14-15)22-16-7-4-8-17(12-16)24-10-2-1-3-11-24/h4-9,12-14H,1-3,10-11H2,(H,22,25).
What are the key properties of N-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide?
N-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide has a molecular weight of 348.41 g/mol, XLogP of 3.98, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-piperidin-1-ylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 86832440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).