N-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide

C13H14N2O3 — CID 17217707

IUPACN-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide
SMILESCC(C)Oc1cccc(C(=O)Nc2ccon2)c1
InChIInChI=1S/C13H14N2O3/c1-9(2)18-11-5-3-4-10(8-11)13(16)14-12-6-7-17-15-12/h3-9H,1-2H3,(H,14,15,16)
InChIKeyUGEGTWFGNYJMJM-UHFFFAOYSA-N
MW246.27 g/mol
LogP2.71
Rot. Bonds4

About N-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide

N-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide (PubChem CID 17217707) has the molecular formula C13H14N2O3 and a molecular weight of 246.27 g/mol. Its IUPAC name is N-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide
PubChem CID17217707
Molecular FormulaC13H14N2O3
Molecular Weight246.27 g/mol
Exact Mass246.10
IUPAC NameN-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide
SMILESCC(C)Oc1cccc(C(=O)Nc2ccon2)c1
InChIInChI=1S/C13H14N2O3/c1-9(2)18-11-5-3-4-10(8-11)13(16)14-12-6-7-17-15-12/h3-9H,1-2H3,(H,14,15,16)
InChIKeyUGEGTWFGNYJMJM-UHFFFAOYSA-N
XLogP2.71
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,2-oxazol-3-yl)-2-(3-propan-2-yloxyphenyl)acetamide
CID 75399150
3-methyl-N-(1,2-oxazol-3-yl)benzamide
CID 17217691
N-propan-2-yl-3-propan-2-yloxybenzamide
CID 8779048
N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide
CID 4318037
N-(2-cyanophenyl)-3-propan-2-yloxybenzamide
CID 924558
3-propan-2-yloxy-N-[4-[[4-[(3-propan-2-yloxybenzoyl)amino]phenyl]methyl]phenyl]benzamide
CID 17142916
3,4-dimethoxy-N-(1,2-oxazol-3-yl)benzamide
CID 17217711
N-(4-phenoxyphenyl)-3-propan-2-yloxybenzamide
CID 8779117
dimethyl 5-[(3-propan-2-yloxybenzoyl)amino]benzene-1,3-dicarboxylate
CID 1339052
N-(3-bromo-4-fluorophenyl)-3-propan-2-yloxybenzamide
CID 104779320
N-(3-amino-4-bromophenyl)-3-propan-2-yloxybenzamide
CID 79753661
3-propan-2-yloxy-N-(1-propan-2-ylpyrazol-4-yl)benzamide
CID 134702922

Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide?
The IUPAC name of N-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide (CID 17217707) is N-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide.
What is the SMILES notation for N-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide?
The canonical SMILES for N-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide is CC(C)Oc1cccc(C(=O)Nc2ccon2)c1.
What is the InChIKey of N-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide?
The InChIKey is UGEGTWFGNYJMJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3/c1-9(2)18-11-5-3-4-10(8-11)13(16)14-12-6-7-17-15-12/h3-9H,1-2H3,(H,14,15,16).
What are the key properties of N-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide?
N-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide has a molecular weight of 246.27 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-3-yl)-3-propan-2-yloxybenzamide is sourced from PubChem (CID 17217707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).