N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide

C14H16N2O4 — CID 106372869

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide
SMILESCCc1cnc(CNC(=O)c2ccc(OC)c(O)c2)o1
InChIInChI=1S/C14H16N2O4/c1-3-10-7-15-13(20-10)8-16-14(18)9-4-5-12(19-2)11(17)6-9/h4-7,17H,3,8H2,1-2H3,(H,16,18)
InChIKeyZWEDWZKXJILDDP-UHFFFAOYSA-N
MW276.29 g/mol
LogP1.88
Rot. Bonds5

About N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide (PubChem CID 106372869) has the molecular formula C14H16N2O4 and a molecular weight of 276.29 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide
PubChem CID106372869
Molecular FormulaC14H16N2O4
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide
SMILESCCc1cnc(CNC(=O)c2ccc(OC)c(O)c2)o1
InChIInChI=1S/C14H16N2O4/c1-3-10-7-15-13(20-10)8-16-14(18)9-4-5-12(19-2)11(17)6-9/h4-7,17H,3,8H2,1-2H3,(H,16,18)
InChIKeyZWEDWZKXJILDDP-UHFFFAOYSA-N
XLogP1.88
TPSA84.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-3-hydroxy-4-methoxybenzamide
CID 79600193
3-hydroxy-4-methoxy-N-[(1-methyl-1,2,4-triazol-3-yl)methyl]benzamide
CID 103884841
4-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]-2-methoxyphenol
CID 106369147
4-amino-N-ethyl-3-[(5-ethyl-1,3-oxazol-2-yl)methylamino]benzamide
CID 106369443
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3,4-dimethoxybenzamide
CID 87043417
4-(2-amino-2-oxoethoxy)-N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-3-methoxybenzamide
CID 119140346
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-4-methoxybenzamide
CID 87043362
N-[2-(ethylamino)ethyl]-3-hydroxy-4-methoxybenzamide
CID 79733239
3-hydroxy-4-methoxy-N-[2-(propylamino)ethyl]benzamide
CID 79733240
3-hydroxy-N-[[3-(hydroxymethyl)phenyl]methyl]-4-methoxybenzamide
CID 79589957
N-(2,2-dimethoxyethyl)-3-hydroxy-4-methoxybenzamide
CID 79726174
N-(2,2-diethoxyethyl)-3-hydroxy-4-methoxybenzamide
CID 79726717

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide (CID 106372869) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide is CCc1cnc(CNC(=O)c2ccc(OC)c(O)c2)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide?
The InChIKey is ZWEDWZKXJILDDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4/c1-3-10-7-15-13(20-10)8-16-14(18)9-4-5-12(19-2)11(17)6-9/h4-7,17H,3,8H2,1-2H3,(H,16,18).
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide has a molecular weight of 276.29 g/mol, XLogP of 1.88, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxy-4-methoxybenzamide is sourced from PubChem (CID 106372869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).