N-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide

C13H14N2O4 — CID 111448157

IUPACN-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide
SMILESO=C(NCCO)c1cccc(OCc2ccon2)c1
InChIInChI=1S/C13H14N2O4/c16-6-5-14-13(17)10-2-1-3-12(8-10)18-9-11-4-7-19-15-11/h1-4,7-8,16H,5-6,9H2,(H,14,17)
InChIKeyLGFXDLIXKUCXMX-UHFFFAOYSA-N
MW262.26 g/mol
LogP0.98
Rot. Bonds6

About N-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide

N-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide (PubChem CID 111448157) has the molecular formula C13H14N2O4 and a molecular weight of 262.26 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide
PubChem CID111448157
Molecular FormulaC13H14N2O4
Molecular Weight262.26 g/mol
Exact Mass262.10
IUPAC NameN-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide
SMILESO=C(NCCO)c1cccc(OCc2ccon2)c1
InChIInChI=1S/C13H14N2O4/c16-6-5-14-13(17)10-2-1-3-12(8-10)18-9-11-4-7-19-15-11/h1-4,7-8,16H,5-6,9H2,(H,14,17)
InChIKeyLGFXDLIXKUCXMX-UHFFFAOYSA-N
XLogP0.98
TPSA84.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.26
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(2,6-dimethylphenyl)methoxy]-N-(2-hydroxyethyl)benzamide
CID 111448156
N-[3-(1,2-oxazol-3-ylmethoxy)phenyl]acetamide
CID 26435226
N-(2-hydroxyethyl)-3-prop-2-ynoxybenzamide
CID 154752881
3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide
CID 4958095
N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide
CID 171338561
3-propoxy-N-[2-[(3-propoxybenzoyl)amino]ethyl]benzamide
CID 4960567
3-ethoxy-N-[3-[(3-ethoxybenzoyl)amino]propyl]benzamide
CID 4958099
3-(chloromethyl)-N-(1,2-oxazol-3-ylmethyl)benzamide
CID 81170534
N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(1,3-thiazol-4-ylmethoxy)benzamide
CID 46649516
3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-propylbenzamide
CID 30661051
N-[2-(ethylamino)ethyl]-3-(pyridin-3-ylmethoxy)benzamide
CID 119506040
3,4-dichloro-N-[2-[[3-(pyridin-3-ylmethoxy)benzoyl]amino]ethyl]benzamide
CID 78889118

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide?
The IUPAC name of N-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide (CID 111448157) is N-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide.
What is the SMILES notation for N-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide?
The canonical SMILES for N-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide is O=C(NCCO)c1cccc(OCc2ccon2)c1.
What is the InChIKey of N-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide?
The InChIKey is LGFXDLIXKUCXMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O4/c16-6-5-14-13(17)10-2-1-3-12(8-10)18-9-11-4-7-19-15-11/h1-4,7-8,16H,5-6,9H2,(H,14,17).
What are the key properties of N-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide?
N-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide has a molecular weight of 262.26 g/mol, XLogP of 0.98, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-3-(1,2-oxazol-3-ylmethoxy)benzamide is sourced from PubChem (CID 111448157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).