N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide

C25H29N3O5 — CID 59487060

IUPACN-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide
SMILESCCN(O)C(=O)N1CCC(c2nc(-c3ccc(OC)cc3)c(-c3cccc(OC)c3)o2)CC1
InChIInChI=1S/C25H29N3O5/c1-4-28(30)25(29)27-14-12-18(13-15-27)24-26-22(17-8-10-20(31-2)11-9-17)23(33-24)19-6-5-7-21(16-19)32-3/h5-11,16,18,30H,4,12-15H2,1-3H3
InChIKeyBXBIAZRGPZKAOT-UHFFFAOYSA-N
MW451.52 g/mol
LogP5.04
Rot. Bonds6

About N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide

N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide (PubChem CID 59487060) has the molecular formula C25H29N3O5 and a molecular weight of 451.52 g/mol. Its IUPAC name is N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide
PubChem CID59487060
Molecular FormulaC25H29N3O5
Molecular Weight451.52 g/mol
Exact Mass451.21
IUPAC NameN-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide
SMILESCCN(O)C(=O)N1CCC(c2nc(-c3ccc(OC)cc3)c(-c3cccc(OC)c3)o2)CC1
InChIInChI=1S/C25H29N3O5/c1-4-28(30)25(29)27-14-12-18(13-15-27)24-26-22(17-8-10-20(31-2)11-9-17)23(33-24)19-6-5-7-21(16-19)32-3/h5-11,16,18,30H,4,12-15H2,1-3H3
InChIKeyBXBIAZRGPZKAOT-UHFFFAOYSA-N
XLogP5.04
TPSA88.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.52
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

N-ethyl-N-hydroxy-4-[4-(4-methoxyphenyl)-5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]piperidine-1-carboxamide
CID 59486748
2-[[4-[4,5-bis(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carbonyl]-hydroxyamino]acetic acid
CID 59486667
4-[4,5-bis(4-methoxyphenyl)-1,3-oxazol-2-yl]-N-methoxy-N-methylpiperidine-1-carboxamide
CID 59486654
4-[5-(4-ethylphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]-N-hydroxy-N-methylpiperidine-1-carboxamide
CID 59486965
N-hydroxy-4-[5-(4-hydroxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]-N-methylpiperidine-1-carboxamide
CID 89031755
N-hydroxy-4-[4-(4-methoxyphenyl)-5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide
CID 59486882
N-hydroxy-4-[5-(4-methoxyphenyl)-4-(4-propan-2-yloxyphenyl)-1,3-oxazol-2-yl]-N-methylpiperidine-1-carboxamide
CID 59486528
4-[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]-N-hydroxy-N-propan-2-ylpiperidine-1-carboxamide
CID 59486680
N-ethyl-4-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]-N-hydroxypiperidine-1-carboxamide
CID 59486697
methyl 1-[hydroxy(methyl)carbamoyl]-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-4-carboxylate
CID 59486996
N-(cyanomethyl)-N-hydroxy-4-[5-phenyl-4-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]piperidine-1-carboxamide
CID 162554624
4-[4-(4-chlorophenyl)-5-[4-(hydroxymethyl)phenyl]-1,3-oxazol-2-yl]-N-hydroxy-N-propan-2-ylpiperidine-1-carboxamide
CID 59486627

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide?
The IUPAC name of N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide (CID 59487060) is N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide.
What is the SMILES notation for N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide?
The canonical SMILES for N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide is CCN(O)C(=O)N1CCC(c2nc(-c3ccc(OC)cc3)c(-c3cccc(OC)c3)o2)CC1.
What is the InChIKey of N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide?
The InChIKey is BXBIAZRGPZKAOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N3O5/c1-4-28(30)25(29)27-14-12-18(13-15-27)24-26-22(17-8-10-20(31-2)11-9-17)23(33-24)19-6-5-7-21(16-19)32-3/h5-11,16,18,30H,4,12-15H2,1-3H3.
What are the key properties of N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide?
N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide has a molecular weight of 451.52 g/mol, XLogP of 5.04, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-hydroxy-4-[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide is sourced from PubChem (CID 59487060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).