2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide

C19H22N4O3 — CID 29097115

IUPAC2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide
SMILESCCCn1ccc(NC(=O)c2ccccc2OCc2c(C)noc2C)n1
InChIInChI=1S/C19H22N4O3/c1-4-10-23-11-9-18(21-23)20-19(24)15-7-5-6-8-17(15)25-12-16-13(2)22-26-14(16)3/h5-9,11H,4,10,12H2,1-3H3,(H,20,21,24)
InChIKeyLOPSRRGMSUPYMG-UHFFFAOYSA-N
MW354.41 g/mol
LogP3.73
Rot. Bonds7

About 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide

2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide (PubChem CID 29097115) has the molecular formula C19H22N4O3 and a molecular weight of 354.41 g/mol. Its IUPAC name is 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide.

Molecular Properties

Compound Name2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide
PubChem CID29097115
Molecular FormulaC19H22N4O3
Molecular Weight354.41 g/mol
Exact Mass354.17
IUPAC Name2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide
SMILESCCCn1ccc(NC(=O)c2ccccc2OCc2c(C)noc2C)n1
InChIInChI=1S/C19H22N4O3/c1-4-10-23-11-9-18(21-23)20-19(24)15-7-5-6-8-17(15)25-12-16-13(2)22-26-14(16)3/h5-9,11H,4,10,12H2,1-3H3,(H,20,21,24)
InChIKeyLOPSRRGMSUPYMG-UHFFFAOYSA-N
XLogP3.73
TPSA82.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-pyridin-4-ylbenzamide
CID 35828889
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(4-imidazol-1-ylphenyl)benzamide
CID 37182358
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[3-(hydroxymethyl)phenyl]benzamide
CID 112766562
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[4-(2-methylpropanoylamino)phenyl]benzamide
CID 35892647
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[4-(methylcarbamoyl)phenyl]benzamide
CID 36743406
N-(3-bromophenyl)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide
CID 36900169
N-(3-chlorophenyl)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide
CID 9465498
N-(2-acetamidoethyl)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide
CID 43006676
N-(3-butoxypropyl)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide
CID 30544768
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-prop-2-enylbenzamide
CID 30533521
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(2R)-6-methylheptan-2-yl]benzamide
CID 29363896
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(2S)-6-methylheptan-2-yl]benzamide
CID 29363899

Frequently Asked Questions

What is the IUPAC name of 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide?
The IUPAC name of 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide (CID 29097115) is 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide.
What is the SMILES notation for 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide?
The canonical SMILES for 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide is CCCn1ccc(NC(=O)c2ccccc2OCc2c(C)noc2C)n1.
What is the InChIKey of 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide?
The InChIKey is LOPSRRGMSUPYMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O3/c1-4-10-23-11-9-18(21-23)20-19(24)15-7-5-6-8-17(15)25-12-16-13(2)22-26-14(16)3/h5-9,11H,4,10,12H2,1-3H3,(H,20,21,24).
What are the key properties of 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide?
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide has a molecular weight of 354.41 g/mol, XLogP of 3.73, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(1-propylpyrazol-3-yl)benzamide is sourced from PubChem (CID 29097115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).