N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide

C16H20N2O4 — CID 110718737

IUPACN-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide
SMILESCOc1cccc(OC)c1C(=O)NCCc1oc(C)nc1C
InChIInChI=1S/C16H20N2O4/c1-10-12(22-11(2)18-10)8-9-17-16(19)15-13(20-3)6-5-7-14(15)21-4/h5-7H,8-9H2,1-4H3,(H,17,19)
InChIKeySSPDYEGNVSSAKR-UHFFFAOYSA-N
MW304.35 g/mol
LogP2.28
Rot. Bonds6

About N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide

N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide (PubChem CID 110718737) has the molecular formula C16H20N2O4 and a molecular weight of 304.35 g/mol. Its IUPAC name is N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide.

Molecular Properties

Compound NameN-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide
PubChem CID110718737
Molecular FormulaC16H20N2O4
Molecular Weight304.35 g/mol
Exact Mass304.14
IUPAC NameN-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide
SMILESCOc1cccc(OC)c1C(=O)NCCc1oc(C)nc1C
InChIInChI=1S/C16H20N2O4/c1-10-12(22-11(2)18-10)8-9-17-16(19)15-13(20-3)6-5-7-14(15)21-4/h5-7H,8-9H2,1-4H3,(H,17,19)
InChIKeySSPDYEGNVSSAKR-UHFFFAOYSA-N
XLogP2.28
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3,4,5-trimethoxybenzamide
CID 110718742
2,6-dimethoxy-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]benzamide
CID 110717671
2,6-dimethoxy-N-[2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]ethyl]benzamide
CID 110641191
2,6-dimethoxy-N-(2-methoxyethyl)benzamide
CID 4128287
2-(2-methoxyphenyl)-N-[2-(2-methyl-4-phenyl-1,3-oxazol-5-yl)ethyl]acetamide
CID 110671433
3,4-dimethoxy-N-[2-(2-methyl-4-phenyl-1,3-oxazol-5-yl)ethyl]benzamide
CID 110671401
N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,3,4-trifluorobenzamide
CID 110718765
N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide
CID 110718749
2,6-dimethoxy-N-[2-(3,4,5-trimethylpyrazol-1-yl)ethyl]benzamide
CID 110716759
2,6-dimethoxy-N-[2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl]benzamide
CID 110324222
N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2-(3-fluorophenoxy)acetamide
CID 110718805
N-[2-(ethylamino)ethyl]-2,6-dimethoxybenzamide
CID 62658406

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide?
The IUPAC name of N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide (CID 110718737) is N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide.
What is the SMILES notation for N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide?
The canonical SMILES for N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide is COc1cccc(OC)c1C(=O)NCCc1oc(C)nc1C.
What is the InChIKey of N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide?
The InChIKey is SSPDYEGNVSSAKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O4/c1-10-12(22-11(2)18-10)8-9-17-16(19)15-13(20-3)6-5-7-14(15)21-4/h5-7H,8-9H2,1-4H3,(H,17,19).
What are the key properties of N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide?
N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide has a molecular weight of 304.35 g/mol, XLogP of 2.28, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide is sourced from PubChem (CID 110718737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).