2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide

C17H18N4O3 — CID 100829367

IUPAC2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide
SMILESCc1cc(NC(=O)C(C)(C)Oc2ccn(-c3ccccc3)n2)no1
InChIInChI=1S/C17H18N4O3/c1-12-11-14(20-24-12)18-16(22)17(2,3)23-15-9-10-21(19-15)13-7-5-4-6-8-13/h4-11H,1-3H3,(H,18,20,22)
InChIKeyFXAZBLCWZQWGRS-UHFFFAOYSA-N
MW326.36 g/mol
LogP2.96
Rot. Bonds5

About 2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide

2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide (PubChem CID 100829367) has the molecular formula C17H18N4O3 and a molecular weight of 326.36 g/mol. Its IUPAC name is 2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide.

Molecular Properties

Compound Name2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide
PubChem CID100829367
Molecular FormulaC17H18N4O3
Molecular Weight326.36 g/mol
Exact Mass326.14
IUPAC Name2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide
SMILESCc1cc(NC(=O)C(C)(C)Oc2ccn(-c3ccccc3)n2)no1
InChIInChI=1S/C17H18N4O3/c1-12-11-14(20-24-12)18-16(22)17(2,3)23-15-9-10-21(19-15)13-7-5-4-6-8-13/h4-11H,1-3H3,(H,18,20,22)
InChIKeyFXAZBLCWZQWGRS-UHFFFAOYSA-N
XLogP2.96
TPSA82.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-methyl-2-(1-phenylpyrazol-3-yl)oxy-N-pyridin-2-ylpropanamide
CID 100830098
(2R)-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide
CID 100828981
2-methyl-N-(2-methyl-3-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxypropanamide
CID 100830011
2-methyl-2-(1-phenylpyrazol-3-yl)oxy-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 100829342
2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenyltetrazol-5-yl)sulfanylpropanamide
CID 50929447
(2S)-2-(4-chloro-1-phenylpyrazol-3-yl)oxy-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 100829245
2-methyl-2-(methylamino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 62836911
N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 569560
phenyl N-(5-methyl-1,2-oxazol-3-yl)carbamate
CID 4519264
2,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-3-oxo-3-pyrrolidin-1-ylpropanamide
CID 108958534
N-(2-chlorophenyl)-2,2-dimethyl-N'-(5-methyl-1,2-oxazol-3-yl)propanediamide
CID 108968909
N-benzyl-N,2,2-trimethyl-N'-(5-methyl-1,2-oxazol-3-yl)propanediamide
CID 108962380

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide?
The IUPAC name of 2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide (CID 100829367) is 2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide.
What is the SMILES notation for 2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide?
The canonical SMILES for 2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide is Cc1cc(NC(=O)C(C)(C)Oc2ccn(-c3ccccc3)n2)no1.
What is the InChIKey of 2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide?
The InChIKey is FXAZBLCWZQWGRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O3/c1-12-11-14(20-24-12)18-16(22)17(2,3)23-15-9-10-21(19-15)13-7-5-4-6-8-13/h4-11H,1-3H3,(H,18,20,22).
What are the key properties of 2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide?
2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide has a molecular weight of 326.36 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide is sourced from PubChem (CID 100829367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).